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20357-21-5 | Benzaldehyde, 2-bromo-6-nitro-
CAS No: 20357-21-5 Catalog No: AG0028ZQ MDL No:MFCD09040530
Product Description
Catalog Number:
AG0028ZQ
Chemical Name:
Benzaldehyde, 2-bromo-6-nitro-
CAS Number:
20357-21-5
Molecular Formula:
C7H4BrNO3
Molecular Weight:
230.0156
MDL Number:
MFCD09040530
IUPAC Name:
2-bromo-6-nitrobenzaldehyde
InChI:
InChI=1S/C7H4BrNO3/c8-6-2-1-3-7(9(11)12)5(6)4-10/h1-4H
InChI Key:
WRIAMYXQKSDDRP-UHFFFAOYSA-N
SMILES:
O=Cc1c(Br)cccc1[N+](=O)[O-]
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.937g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.017g/mol
Monoisotopic Mass:
228.937g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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