1-(4-Methylcyclohexyl)piperazine

HCID 796165
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Basic information

CAS
435345-42-9
Standard SMILES
CC1CCC(N2CCNCC2)CC1
InChIKey
JSPCWYQQBFGMBJ-UHFFFAOYSA-N
Molecular formula
C11H22N2
Average molar mass
182.31 g/mol
Monoisotopic mass
182.1782987

Names & identifiers

Preferred name
1-(4-Methylcyclohexyl)piperazine
IUPAC
1-(4-methylcyclohexyl)piperazine
English name
1-(4-Methyl-cyclohexyl)-piperazine
Molecular formula
C11H22N2
Molecular weight
182.31

Names & synonyms

1-(4-methylcyclohexyl)piperazine435345-42-91-(4-Methyl-cyclohexyl)-piperazine355378-95-9460046-46-21-(4-Methyl-cyclohexyl)-piperazine hydrochloridePIPERAZINE, 1-(CIS-4-METHYLCYCLOHEXYL)- (9CI)MFCD03119781Rel-1-((1s,4s)-4-methylcyclohexyl)piperazine1-(4-Methyl-cyclohexyl)-piperazinehydrochloride460365-14-4Oprea1_759113
Show more names
Oprea1_857512SCHEMBL736861(4-methylcyclohexyl)piperazineSCHEMBL6132381SCHEMBL6132383CHEMBL1622483DTXSID60963041JSPCWYQQBFGMBJ-PHIMTYICSA-N

Database identifiers

CAS
435345-42-9
PubChem CID
796165
DTXSID
DTXSID60963041
ChEMBL
CHEMBL1622483

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
15.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
13

Physicochemical properties

Symbol(GHS)
5 · GHS05
Signal word
Danger
Hazard statements
314 · H314
Precautionary statements
501 · P501-P260-P264-P280-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P405
Risk Statements
41 · 41
Safety Statements
26 · 26-39

Safety & regulation

Safety data

risk_code
41
Signal word
Danger
Symbol(GHS)
GHS05
safety_code
26-39
Hazard statements
H314
Precautionary statements
P501-P260-P264-P280-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P405

Chemistry & industry

Suppliers2 total

武汉凯威斯科技有限公司86-027-67849912 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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