CAS 7731-02-4 1-Cyclohexylpyrrolidine (HCID 139064)

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Basic information

CAS: 7731-02-4
Standard SMILES: C1CCC(N2CCCC2)CC1
InChIKey: ULBBXWVIXXPSOD-UHFFFAOYSA-N
Molecular formula: C10H19N
Average molar mass: 153.26 g/mol
Monoisotopic mass: 153.15174961

Overview

N-cyclohexylpyrrolidine is an N-alkylpyrrolidine that is pyrrolidine in which the hydrogen attached to the nitrogen has been replaced by a cyclohexyl group.

Names & identifiers

Preferred name: 1-Cyclohexylpyrrolidine
IUPAC: 1-cyclohexylpyrrolidine
English name: 1-Cyclohexyl-pyrrolidine
Molecular formula: C10H19N
Molecular weight: 153.26

Names & synonyms

1-cyclohexylpyrrolidine7731-02-4N-cyclohexylpyrrolidinePyrrolidine, 1-cyclohexyl-CHEBI:39032DTXSID00228060RefChem:1055315DTXCID201505511-CYCLOHEXYL-PYRROLIDINEMFCD09032128Pyrrolidine,1-cyclohexyl-cyclohexylpyrrolidine

Show more names

SKL0291-Cyclohexylpyrolidine

cyclohexyl pyrrolidineSCHEMBL61458SCHEMBL735235SCHEMBL736079SCHEMBL736119SCHEMBL737435SCHEMBL7382201-(1-pyrrolidinyl)cyclohexane

Database identifiers

CAS: 7731-02-4
PubChem CID: 139064
DTXSID: DTXSID00228060
ChEBI: CHEBI:39032
Nikkaji: J1.091.482E

Properties

Computed structural properties

XLogP: 2.6
Topological polar surface area: 3.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 11
Formal charge: 0
Complexity: 110

Physicochemical properties

Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P264-P270-P271-P280-P301+P312+P330-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
HazardClass: IRRITANT

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
hazard_class: IRRITANT
Hazard statements: H302-H315-H319-H335
Precautionary statements: P261-P264-P270-P271-P280-P301+P312+P330-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501

Chemistry & industry

Suppliers10 total

杭州鸿喜生物医药科技有限公司18989489206 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

Sichuan Biosynce Pharmatech Co., Ltd.[email protected]

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]

Additional notes

DefinitionChEBI: An N-alkylpyrrolidine that is pyrrolidine in which the hydrogen attached to the nitrogen has been replaced by a cyclohexyl group.