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421-37-4 | 1-bromo-1,1-difluoropropan-2-one
CAS No: 421-37-4 Catalog No: AG01ELVS MDL No:MFCD31428817
Product Description
Catalog Number:
AG01ELVS
Chemical Name:
1-bromo-1,1-difluoropropan-2-one
CAS Number:
421-37-4
Molecular Formula:
C3H3BrF2O
Molecular Weight:
172.9561
MDL Number:
MFCD31428817
IUPAC Name:
1-bromo-1,1-difluoropropan-2-one
InChI:
InChI=1S/C3H3BrF2O/c1-2(7)3(4,5)6/h1H3
InChI Key:
QEOBPMIXVYRLKE-UHFFFAOYSA-N
SMILES:
CC(=O)C(Br)(F)F
Properties
Complexity:
90.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.934g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.957g/mol
Monoisotopic Mass:
171.934g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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