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Reference substances

Reference substances

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General information

Inventory

EC number:
220-666-8
EC name:
3-aminomethyl-3,5,5-trimethylcyclohexylamine
CAS number:
2855-13-2

No inventory information available

Reference substance information

IUPAC name:
3-(aminomethyl)-3,5,5-trimethylcyclohexanamine
Synonyms
Names:
Cyclohexanemethanamine, 5-amino-1,3,3-trimethyl-
Identifier:
IUPAC name
3-aminomethyl-3,5,5-trimethylcyclohexylamine
Identifier:
other: InChl
InChI=1S/C10H22N2/c1-9(2)4-8(12)5-10(3,6-9)7-11/h8H,4-7,11-12H2,1-3H3
Identifier:
other: SMILES notation
NCC(CC(N)CC1(C)C)(C1)C
Identifier:
other: SMILES notation
NCC1(C)CC(C)(C)CC(N)C1

CAS information

CAS number:
2855-13-2

Molecular and structural information

Molecular formula:
C10H22N2
Molecular weight:
170.295
SMILES notation:
CC1(C)CC(N)CC(C)(CN)C1
InChl:
InChI=1/C10H22N2/c1-9(2)4-8(12)5-10(3,6-9)7-11/h8H,4-7,11-12H2,1-3H3
Structural formula:
Chemical structure