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951894-31-8 | 2-Bromo-3-(4-chloro-2-fluorophenyl)-1-propene
CAS No: 951894-31-8 Catalog No: AG01F04F MDL No:
Product Description
Catalog Number:
AG01F04F
Chemical Name:
2-Bromo-3-(4-chloro-2-fluorophenyl)-1-propene
CAS Number:
951894-31-8
Molecular Formula:
C9H7BrClF
Molecular Weight:
249.5073
IUPAC Name:
1-(2-bromoprop-2-enyl)-4-chloro-2-fluorobenzene
InChI:
InChI=1S/C9H7BrClF/c1-6(10)4-7-2-3-8(11)5-9(7)12/h2-3,5H,1,4H2
InChI Key:
QNGKKIKSGJVHNA-UHFFFAOYSA-N
SMILES:
BrC(=C)Cc1ccc(cc1F)Cl
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.94g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.507g/mol
Monoisotopic Mass:
247.94g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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