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88260-02-0 | 2-Azabicyclo[2.2.1]heptane-3-carboxylic acid, hydrochloride
CAS No: 88260-02-0 Catalog No: AG004ABB MDL No:
Product Description
Catalog Number:
AG004ABB
Chemical Name:
2-Azabicyclo[2.2.1]heptane-3-carboxylic acid, hydrochloride
CAS Number:
88260-02-0
Molecular Formula:
C7H12ClNO2
Molecular Weight:
177.6287
IUPAC Name:
2-azabicyclo[2.2.1]heptane-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C7H11NO2.ClH/c9-7(10)6-4-1-2-5(3-4)8-6;/h4-6,8H,1-3H2,(H,9,10);1H
InChI Key:
WUKAJPOKLIRLLD-UHFFFAOYSA-N
SMILES:
OC(=O)C1NC2CC1CC2.Cl
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.056g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
177.628g/mol
Monoisotopic Mass:
177.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
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