Basic information
- CAS
940-36-3- Standard SMILES
COC(=O)Nc1ccc(Cl)cc1- InChIKey
CRGWHGISCDFEJY-UHFFFAOYSA-N- Molecular formula
- C8H8ClNO2
- Average molar mass
- 185.61 g/mol
- Monoisotopic mass
- 185.02435618
Names & identifiers
- Preferred name
- Carbamic acid, (4-chlorophenyl)-, methyl ester
- IUPAC
- methyl N-(4-chlorophenyl)carbamate
- English name
- N-(4-Chlorophenyl)carbamic acid methyl ester
- Molecular formula
- C8H8ClNO2
- Molecular weight
- 185.61
Names & synonyms
940-36-3methyl (4-chlorophenyl)carbamatemethyl N-(4-chlorophenyl)carbamateMethyl p-chlorophenylcarbamateCarbamic acid, (4-chlorophenyl)-, methyl esterMFCD00018569Carbanilic acid, p-chloro-, methyl esterN-(4-Chlorophenyl)carbamic acid methyl esterp-Chlorocarbanilic acid methyl ester4-Chlorophenylcarbamic acid methyl ester(4-Chlorophenyl)carbamic acid methyl esterMethyl p-chlorocarbanilate
Show more names
Chlorophenyl methylcarbamateCarbamic acid, N-(4-chlorophenyl)-, methyl ester
Methyl 4-chlorocarbanilateMethyl 4-chlorophenylcarbamateSCHEMBL1188088SCHEMBL1195768SCHEMBL2094114Methyl 4-chlorophenylcarbamate #DTXSID50240191N-(4-chlorophenyl)methoxycarboxamide
Database identifiers
- CAS
940-36-3- PubChem CID
- 70326
- DTXSID
DTXSID50240191- Nikkaji
- J122.198A
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 155
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Physicochemical properties
- Melting point
- 117 · 117-117.5 °C
- Boiling point
- 220.9 · 220.9±23.0 °C(Predicted)
- Density
- 1.317 · 1.317±0.06 g/cm3(Predicted)
- pka
- 12.99 · 12.99±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers22 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
湖北魏氏化学试剂股份有限公司17771898297 13125137661 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
郑州安步防护用具有限公司+86-0371-88006763; +86-15988602810 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
上海超岚化工科技中心QQ：65489617 13301690235 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
上海康恩博医药科技有限公司400-1388-521 17510465506 · [email protected]
南京佳聚医药科技有限公司13022518189 · [email protected]
深圳利斯康医药科技有限公司+86-755-89396905 +86-15013857715 · [email protected]
郑州艾克姆化工有限公司13303867194 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
上海杰股生物科技有限公司021-51698675 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
江苏艾康生物医药研发有限公司17714375163 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Henan Fengda Chemical Co., Ltd+86-371-86557731 +86-13613820652 · [email protected]
Related reactions
2 records
Compound notes
Loading…