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2055839-95-5 | Cyclobutanemethanamine, 2,2-difluoro-, hydrochloride (1:1)
CAS No: 2055839-95-5 Catalog No: AG002A7F MDL No:
Product Description
Catalog Number:
AG002A7F
Chemical Name:
Cyclobutanemethanamine, 2,2-difluoro-, hydrochloride (1:1)
CAS Number:
2055839-95-5
Molecular Formula:
C5H10ClF2N
Molecular Weight:
157.5894
IUPAC Name:
(2,2-difluorocyclobutyl)methanamine;hydrochloride
InChI:
InChI=1S/C5H9F2N.ClH/c6-5(7)2-1-4(5)3-8;/h4H,1-3,8H2;1H
InChI Key:
YBIVAKBKIJCQGS-UHFFFAOYSA-N
SMILES:
NCC1CCC1(F)F.Cl
Properties
Complexity:
92.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.047g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
157.589g/mol
Monoisotopic Mass:
157.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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