Home Carboxys cis-3-aminocyclohexane-1-carboxylic acid hydrochloride

cis-3-aminocyclohexane-1-carboxylic acid hydrochloride

CAS No.:
118785-96-9
Catalog Number:
AG00IKXK
Molecular Formula:
C7H14ClNO2
Molecular Weight:
179.6446
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Product Description
Catalog Number:
AG00IKXK
Chemical Name:
cis-3-aminocyclohexane-1-carboxylic acid hydrochloride
CAS Number:
118785-96-9
Molecular Formula:
C7H14ClNO2
Molecular Weight:
179.6446
MDL Number:
MFCD00787794
IUPAC Name:
(1R,3S)-3-aminocyclohexane-1-carboxylic acid;hydrochloride
InChI:
InChI=1S/C7H13NO2.ClH/c8-6-3-1-2-5(4-6)7(9)10;/h5-6H,1-4,8H2,(H,9,10);1H/t5-,6+;/m1./s1
InChI Key:
BOUHXQPJYJANEO-IBTYICNHSA-N
SMILES:
N[C@H]1CCC[C@H](C1)C(=O)O.Cl
Properties
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
179.071g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
179.644g/mol
Monoisotopic Mass:
179.071g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties