硝酸丙酯

  • 基本信息
  • 制备方法及用途
  • 物化性质
  • 安全信息
  • 毒理性
  • MSDS
  • 结构与计算化学
  • 上游产品
  • 下游产品

硝酸丙酯 基本信息

中文名称:
硝酸丙酯 
中文别名:
硝酸丙酯;
硝基正丙酯;
硝酸正丙酯 
英文名称:
Nitric acid, propylester
英文别名:
Propyl nitrate;
Monopropyl nitrate;
Nitrate de propyle normal [French];
UN1865;
Propylester kyseliny dusicne [Czech];
hydroxypropan nitrate;
N-PROPYL NITRATE;
EINECS 210-985-0;
1-propyl nitrate;
Nitric acid,propyl ester;
1-nitrooxypropane 
CAS No.:
627-13-4
分 子 式:

C3H7NO3

分 子 量:
105.11
精确分子量:
105.04300
PSA:
55.05000
EINECS:
210-985-0
InChI:
The Key: JNTOKFNBDFMTIV-UHFFFAOYSA-N
危险品标志:

 

风险术语:

 

安全术语:

 

分子结构式:
SDS:
查看

硝酸丙酯 制备方法及用途

用途

用作火箭燃料,化学试剂等。[22]

硝酸丙酯 物化性质

密度:
1.05
熔点:
-100ºC
沸点:
110.5ºC
折射率:
1.402
存储条件/存储方法:
库房通风低温干燥,与氧化剂分开存放
稳定性相关:

1.稳定性[16]  稳定

2.禁配物[17]  强还原剂、强酸、磷、铝、硫

3.避免接触的条件[18]  受热

4.聚合危害[19]  不聚合

5.分解产物[20]  氮氧化物

其它信息:

1.性状:白色至淡黄色液体,有类似醚的气味。[1]

2.熔点(℃):-100[2]

3.沸点(℃):110.5[3]

4.相对密度(水=1):1.05[4]

5.相对蒸气密度(空气=1):3.62[5]

6.饱和蒸气压(kPa):2.43(20℃)[6]

7.辛醇/水分配系数:1.74(计算)[7]

8.闪点(℃):20[8]

9.引燃温度(℃):175[9]

10.爆炸上限(%):100.0[10]

11.爆炸下限(%):2.0[11]

12.溶解性:不溶于水,溶于乙醇、乙醚。[12]

硝酸丙酯 安全信息

包装等级:
II
风险类别:
3.1

硝酸丙酯 毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UK0350000
CHEMICAL NAME :
n-Propyl nitrate
CAS REGISTRY NUMBER :
627-13-4
BEILSTEIN REFERENCE NO. :
1701406
LAST UPDATED :
199712
DATA ITEMS CITED :
27
MOLECULAR FORMULA :
C3-H7-N-O3
MOLECULAR WEIGHT :
105.11
WISWESSER LINE NOTATION :
WNO3

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
5816 ppm/4H
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Lungs, Thorax, or Respiration - cyanosis
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 19,80,1958
TYPE OF TEST :
LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
5816 ppm/4H
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - cyanosis
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 19,80,1958
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 118,77,1956
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Mammal - cat
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 118,77,1956
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
200 mg/kg
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 118,77,1956 *** REVIEWS *** ACGIH TLV-STEL 172 mg/m3 (40 ppm) DTLVS* The Threshold Limit Values (TLVs) and Biological Exposure Indices (BEIs) booklet issues by American Conference of Governmental Industrial Hygienists (ACGIH), Cincinnati, OH, 1996 Volume(issue)/page/year: TLV/BEI,1997 ACGIH TLV-TWA 107 mg/m3 (25 ppm) DTLVS* The Threshold Limit Values (TLVs) and Biological Exposure Indices (BEIs) booklet issues by American Conference of Governmental Industrial Hygienists (ACGIH), Cincinnati, OH, 1996 Volume(issue)/page/year: TLV/BEI,1997 *** U.S. STANDARDS AND REGULATIONS *** MSHA STANDARD-air:TWA 25 ppm (110 mg/m3) DTLVS* The Threshold Limit Values (TLVs) and Biological Exposure Indices (BEIs) booklet issues by American Conference of Governmental Industrial Hygienists (ACGIH), Cincinnati, OH, 1996 Volume(issue)/page/year: 3,217,1971 OSHA PEL (Gen Indu):8H TWA 25 ppm (110 mg/m3) CFRGBR Code of Federal Regulations. (U.S. Government Printing Office, Supt. of Documents, Washington, DC 20402) Volume(issue)/page/year: 29,1910.1000,1994 OSHA PEL (Construc):8H TWA 25 ppm (110 mg/m3) CFRGBR Code of Federal Regulations. (U.S. Government Printing Office, Supt. of Documents, Washington, DC 20402) Volume(issue)/page/year: 29,1926.55,1994 OSHA PEL (Shipyard):8H TWA 25 ppm (110 mg/m3) CFRGBR Code of Federal Regulations. (U.S. Government Printing Office, Supt. of Documents, Washington, DC 20402) Volume(issue)/page/year: 29,1915.1000,1993 OSHA PEL (Fed Cont):8H TWA 25 ppm (110 mg/m3) CFRGBR Code of Federal Regulations. (U.S. Government Printing Office, Supt. of Documents, Washington, DC 20402) Volume(issue)/page/year: 41,50-204.50,1994 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-AUSTRALIA:TWA 25 ppm (110 mg/m3);STEL 40 ppm (170 mg/m3) JAN 1993 OEL-BELGIUM:TWA 25 ppm (107 mg/m3);STEL 40 ppm (172 mg/m3) JAN 1993 OEL-DENMARK:TWA 25 ppm (110 mg/m3) JAN 1993 OEL-FINLAND:TWA 25 ppm (105 mg/m3);STEL 40 ppm (175 mg/m3) JAN 1993 OEL-FRANCE:TWA 25 ppm (105 mg/m3) JAN 1993 OEL-GERMANY:TWA 25 ppm (110 mg/m3) JAN 1993 OEL-THE NETHERLANDS:TWA 25 ppm (110 mg/m3) JAN 1993 OEL-THE PHILIPPINES:TWA 25 ppm (110 mg/m3) JAN 1993 OEL-SWITZERLAND:TWA 25 ppm (110 mg/m3) JAN 1993 OEL-TURKEY:TWA 25 ppm (110 mg/m3) JAN 1993 OEL IN BULGARIA, COLOMBIA, JORDAN, KOREA check ACGIH TLV OEL IN NEW ZEALAND, SINGAPORE, VIETNAM check ACGIH TLV *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH RECOMMENDED EXPOSURE LEVEL (REL) : NIOSH REL TO n-PROPYL NITRATE-air:10H TWA 25 ppm;STEL 40 ppm REFERENCE : NIOSH* National Institute for Occupational Safety and Health, U.S. Dept. of Health, Education, and Welfare, Reports and Memoranda. Volume(issue)/page/year: DHHS #92-100,1992 NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X7139 No. of Facilities: 30 (estimated) No. of Industries: 2 No. of Occupations: 2 No. of Employees: 1844 (estimated) No. of Female Employees: 272 (estimated)
毒理学数据:

1.急性毒性[13]

LD50:200mg/kg(兔静脉)

LC50:38610mg/m3(大鼠吸入,4h)

2.刺激性  暂无资料

3.亚急性与慢性毒性[14]  大鼠吸入2110ppm,26周,9/20死亡。

生态数据:

1.生态毒性  暂无资料

2.生物降解性  暂无资料

3.非生物降解性[15]  空气中,当羟基自由基浓度为5.00×105个/cm3时,降解半衰期为22d(理论)。

硝酸丙酯 MSDS

第一部分:化学品名称

硝酸丙酯 分子结构与计算化学数据

计算化学数据

1.疏水参数计算参考值(XlogP):1.4

2.氢键供体数量:0

3.氢键受体数量:3

4.可旋转化学键数量:2

5.互变异构体数量:无

6.拓扑分子极性表面积55

7.重原子数量:7

8.表面电荷:0

9.复杂度:57.7

10.同位素原子数量:0

11.确定原子立构中心数量:0

12.不确定原子立构中心数量:0

13.确定化学键立构中心数量:0

14.不确定化学键立构中心数量:0

15.共价键单元数量:1

硝酸丙酯 上游产品

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