tert-Butyl (2-aminocyclohexyl)carbamate

HCID 3268011CAS 317595-54-3
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)OC(=O)NC1CCCCC1N
InChIKey
AKVIZYGPJIWKOS-UHFFFAOYSA-N
Molecular formula
C11H22N2O2
Average molar mass
214.3 g/mol
Monoisotopic mass
214.16812795

Names & identifiers

Preferred name
tert-Butyl (2-aminocyclohexyl)carbamate
IUPAC
tert-butyl N-(2-aminocyclohexyl)carbamate
English name
N-Boc-1,2-Diaminocyclohexane
Molecular formula
C11H22N2O2
Molecular weight
214.3

Names & synonyms

317595-54-3tert-Butyl (2-aminocyclohexyl)carbamateDTXSID20390859RefChem:382929DTXCID20341720Tert-butyl N-(2-aminocyclohexyl)carbamateN-Boc-1,2-Diaminocyclohexane(2-Amino-cyclohexyl)-carbamic acid tert-butyl ester1-Amino-2-(Boc-amino)cyclohexaneMFCD04038473tert-butyl 2-aminocyclohexylcarbamateCis-(1S, 2R)-1N-Boc-cyclohexane-1,2-diamine
Show more names
N-Boc-trans-1N-Boc-cyclohexane-1,2-diaMine1-N-Boc-1,2-Cyclohexyldiamino1-N-Boc-Amino-1,2-cyclohexaned1-N-BOC-AMINO-1,2-CYCLOHEXANEDIAMINECyclohexane-1,2-diamine, 1-BOC protectedCarbamic acid, N-(2-aminocyclohexyl)-, 1,1-dimethylethyl ester
AKOS010026514SB17594(1S,2S)-Boc-1,2-diaminocyclohexane(2-Aminocyclohexyl)carbamic acid tert-butyl ester(1S,2R)-N1-(tert-Butoxycarbonyl)-1,2-cyclohexanediamine1-N-BOC-1,2-CIS-CYCLOHEXYLDIAMINE(1S,2S)-2-Amino-1-(Boc-amino)cyclohexanetert-butyl N-[cis-2-aminocyclohexyl]carbamate

Database identifiers

CAS
317595-54-3
PubChem CID
3268011
DTXSID
DTXSID20390859

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
64.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
15

Physicochemical properties

Boiling point
322.1 · 322.1±31.0 °C(Predicted)
Density
1.02 · 1.02±0.1 g/cm3(Predicted)
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
pka
12.26 · 12.26±0.40(Predicted)
Appearance
41 °C · Yellow to brown 41°C Liquid
Symbol(GHS)
7 · GHS07

Safety & regulation

Safety data

hs_code
2902110000
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Suppliers50 total

上海康恩博医药科技有限公司17510465506 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海颖心实验室设备有限公司021-59178156 17002132182 · [email protected]

Related reactions

28 records
New reaction record

Linked notes

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