Home Carboxys cis-2-Amino-cyclohexanecarboxylic acid ethyl ester hydrochloride

cis-2-Amino-cyclohexanecarboxylic acid ethyl ester hydrochloride

CAS No.:
1127-99-7
Catalog Number:
AG0037XW
Molecular Formula:
C9H18ClNO2
Molecular Weight:
207.6977
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Product Description
Catalog Number:
AG0037XW
Chemical Name:
cis-2-Amino-cyclohexanecarboxylic acid ethyl ester hydrochloride
CAS Number:
1127-99-7
Molecular Formula:
C9H18ClNO2
Molecular Weight:
207.6977
MDL Number:
MFCD00144280
IUPAC Name:
ethyl (1R,2S)-2-aminocyclohexane-1-carboxylate;hydrochloride
InChI:
InChI=1S/C9H17NO2.ClH/c1-2-12-9(11)7-5-3-4-6-8(7)10;/h7-8H,2-6,10H2,1H3;1H/t7-,8+;/m1./s1
InChI Key:
XMQSOBPCWYVZSW-WLYNEOFISA-N
SMILES:
CCOC(=O)[C@@H]1CCCC[C@@H]1N.Cl
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
207.103g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
207.698g/mol
Monoisotopic Mass:
207.103g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties