1-amino-3,3-difluorocyclobutane-1-carboxylic acid

1-amino-3,3-difluorocyclobutane-1-carboxylic acid

CAS: 1225532-86-4

Formula: C5H7F2NO2

SMILES: NC1(CC(F)(F)C1)C(O)=O

IUPAC: 1-amino-3,3-difluorocyclobutane-1-carboxylic acid

InChI: InChI=1S/C5H7F2NO2/c6-5(7)1-4(8,2-5)3(9)10/h1-2,8H2,(H,9,10)

Composition: C (39.74%), H (4.67%), F (25.14%), N (9.27%), O (21.17%)

Molar Mass: 151.113

Atom Count: 17

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	151.044484795
Formal Charge	0
FSP3	0.8
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	KSCVQJSNYDFHOT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	27.32
Topological Polar Surface Area	63.32
Polarizability	11.08
Ring Count	1
Rotatable Bond Count	1

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