Home Other Building Blocks 2,2-DIFLUORO-2-PHENYLETHANAMINE

2,2-DIFLUORO-2-PHENYLETHANAMINE

CAS No.:
55601-21-3
Catalog Number:
AG00DLH7
Molecular Formula:
C8H9F2N
Molecular Weight:
157.1606
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Product Description
Catalog Number:
AG00DLH7
Chemical Name:
2,2-DIFLUORO-2-PHENYLETHANAMINE
CAS Number:
55601-21-3
Molecular Formula:
C8H9F2N
Molecular Weight:
157.1606
MDL Number:
MFCD11100799
IUPAC Name:
2,2-difluoro-2-phenylethanamine
InChI:
InChI=1S/C8H9F2N/c9-8(10,6-11)7-4-2-1-3-5-7/h1-5H,6,11H2
InChI Key:
FZUZAXBAUSXGAV-UHFFFAOYSA-N
SMILES:
NCC(c1ccccc1)(F)F
Properties
Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.07g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
157.164g/mol
Monoisotopic Mass:
157.07g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Evidence that dioxygen and substrate activation are tightly coupled in dopamine beta-monooxygenase. Implications for the reactive oxygen species. The Journal of biological chemistry 20031212
Properties