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25939-12-2 | Benzenecarbohydrazonoyl chloride, 4-bromo-N-phenyl-
CAS No: 25939-12-2 Catalog No: AG002R4E MDL No:
Product Description
Catalog Number:
AG002R4E
Chemical Name:
Benzenecarbohydrazonoyl chloride, 4-bromo-N-phenyl-
CAS Number:
25939-12-2
Molecular Formula:
C13H10BrClN2
Molecular Weight:
309.5889
IUPAC Name:
4-bromo-N-phenylbenzenecarbohydrazonoyl chloride
InChI:
InChI=1S/C13H10BrClN2/c14-11-8-6-10(7-9-11)13(15)17-16-12-4-2-1-3-5-12/h1-9,16H
InChI Key:
XQAFGQJURJIHJD-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)C(=NNc1ccccc1)Cl
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.972g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
309.591g/mol
Monoisotopic Mass:
307.972g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
24.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.3
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