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78347-65-6

78347-65-6 | Butanoic acid, 3-amino-4,4-difluoro-, hydrochloride

CAS No: 78347-65-6 Catalog No: AG005BGM MDL No:

Product Description

Catalog Number:
AG005BGM
Chemical Name:
Butanoic acid, 3-amino-4,4-difluoro-, hydrochloride
CAS Number:
78347-65-6
Molecular Formula:
C4H8ClF2NO2
Molecular Weight:
175.5616
IUPAC Name:
3-amino-4,4-difluorobutanoic acid;hydrochloride
InChI:
InChI=1S/C4H7F2NO2.ClH/c5-4(6)2(7)1-3(8)9;/h2,4H,1,7H2,(H,8,9);1H
InChI Key:
GOMSTRQKMHFOEO-UHFFFAOYSA-N
SMILES:
NC(C(F)F)CC(=O)O.Cl

Properties

Complexity:
107  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.021g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
175.56g/mol
Monoisotopic Mass:
175.021g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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