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177269-37-3 | Propanoic acid, 3-amino-2,2-dimethyl-, methyl ester, hydrochloride (1:1)
CAS No: 177269-37-3 Catalog No: AG00256W MDL No:MFCD10758092
Product Description
Catalog Number:
AG00256W
Chemical Name:
Propanoic acid, 3-amino-2,2-dimethyl-, methyl ester, hydrochloride (1:1)
CAS Number:
177269-37-3
Molecular Formula:
C6H14ClNO2
Molecular Weight:
167.6339
MDL Number:
MFCD10758092
IUPAC Name:
methyl 3-amino-2,2-dimethylpropanoate;hydrochloride
InChI:
InChI=1S/C6H13NO2.ClH/c1-6(2,4-7)5(8)9-3;/h4,7H2,1-3H3;1H
InChI Key:
PHPVVUDRVIMHOI-UHFFFAOYSA-N
SMILES:
NCC(C(=O)OC)(C)C.Cl
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.071g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
167.633g/mol
Monoisotopic Mass:
167.071g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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