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2-Cyclohexylcyclohexan-1-amine

HCID 221997
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
6283-14-3
Standard SMILES
NC1CCCCC1C1CCCCC1
InChIKey
KEHCTKVZDAEDPP-UHFFFAOYSA-N
Molecular formula
C12H23N
Average molar mass
181.32 g/mol
Monoisotopic mass
181.18304974

Names & identifiers

Preferred name
2-Cyclohexylcyclohexan-1-amine
IUPAC
2-cyclohexylcyclohexan-1-amine
English name
2-AMINOBICYCLOHEXYL
Molecular formula
C12H23N
Molecular weight
181.32

Names & synonyms

2-cyclohexylcyclohexan-1-amineRefChem:470942108-288-02-Aminobicyclohexyl6283-14-3[1,1'-Bi(cyclohexan)]-2-amineMFCD000212792-cyclohexylcyclohexylamine[1,1'-Bicyclohexyl]-2-amineNSC7141[Bicyclohexyl]-2-amineo-AMINOBICYCLOHEXYL
Show more names
O-AMINODICYCLOHEXYLTIMTEC-BB SBB008585BICYCLOHEXYL-2-AMINE1,1'-Bi(cyclohexan)]-2-amine3-cyclohexyl-1-cyclohexanamine
2-cyclohexylcyclohexanamineSCHEMBL3889262-aminobicyclohexyl, AldrichCPRSCHEMBL10585693DTXSID00278404NSC-7141AR-1F8064SBB008585

Database identifiers

CAS
6283-14-3
PubChem CID
221997
DTXSID
DTXSID00278404
EC Number
108-288-0
Nikkaji
J1.921.928C

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
26 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
149

Physicochemical properties

Melting point
270 °C · 270 °C
Boiling point
131 °C · 131 °C
Density
0.934 · 0.934±0.06 g/cm3(Predicted)
pka
10.68 · 10.68±0.70(Predicted)
form
solid
InChI
1S/C12H23N/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h10-12H,1-9,13H2
InChIKey
KEHCTKVZDAEDPP-UHFFFAOYSA-N
SMILES
NC1CCCCC1C2CCCCC2
UNSPSC Code
12352200 · 12352200
NACRES
21 · NA.21
Symbol(GHS)
5 · GHS05,GHS07
Signal word
Danger
Hazard statements
302 · H302-H314
Precautionary statements
260 · P260-P270-P280-P301+P312-P303+P361+P353-P305+P351+P338
Hazard Codes
Xn
Risk Statements
22 · 22-36
RIDADR
2735 · UN2735
WGK Germany
3 · 3
HazardClass
8 · 8
Storage Class
8 A · 8A - Combustible corrosive hazardous materials
Hazard Classifications
4 OralEye · Acute Tox. 4 OralEye Dam. 1Skin Corr. 1B
Limited Quantities
5 kg · 5.0 kg (11 lbs) (solid)
Excepted Quantities
Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

wgk
3
ridadr
UN2735
risk_code
22-36
Signal word
Danger
Symbol(GHS)
GHS05,GHS07
hazard_code
Xn
hazard_class
8
Storage Class
8A - Combustible corrosive hazardous materials
Hazard statements
H302-H314
Limited Quantities
5.0 kg (11 lbs) (solid)
Excepted Quantities
Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Hazard Classifications
Acute Tox. 4 OralEye Dam. 1Skin Corr. 1B
Precautionary statements
P260-P270-P280-P301+P312-P303+P361+P353-P305+P351+P338

Chemistry & industry

Suppliers9 total

南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
Aladdin Scientific[email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
海济医药科技(苏州)有限公司18012778619 · [email protected]
扬州瑞宏生物科技有限公司15380367604; 15380367604 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]

Related reactions

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Compound notes

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