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2155855-29-9 | 1-(aminomethyl)-3,3-difluorocyclobutane-1-carboxylic acid hydrochloride
CAS No: 2155855-29-9 Catalog No: AG01FICA MDL No:
Product Description
Catalog Number:
AG01FICA
Chemical Name:
1-(aminomethyl)-3,3-difluorocyclobutane-1-carboxylic acid hydrochloride
CAS Number:
2155855-29-9
Molecular Formula:
C6H10ClF2NO2
Molecular Weight:
201.5989
IUPAC Name:
1-(aminomethyl)-3,3-difluorocyclobutane-1-carboxylic acid;hydrochloride
InChI:
InChI=1S/C6H9F2NO2.ClH/c7-6(8)1-5(2-6,3-9)4(10)11;/h1-3,9H2,(H,10,11);1H
InChI Key:
RWLXZUSFBYIGKE-UHFFFAOYSA-N
SMILES:
NCC1(CC(C1)(F)F)C(=O)O.Cl
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.037g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
201.598g/mol
Monoisotopic Mass:
201.037g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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