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Home > Aldehydes > 486404-39-1
486404-39-1 | Benzaldehyde, 3,6-dibromo-2,4-dihydroxy-
CAS No: 486404-39-1 Catalog No: AG006WP4 MDL No:
Product Description
Catalog Number:
AG006WP4
Chemical Name:
Benzaldehyde, 3,6-dibromo-2,4-dihydroxy-
CAS Number:
486404-39-1
Molecular Formula:
C7H4Br2O3
Molecular Weight:
295.9129
IUPAC Name:
3,6-dibromo-2,4-dihydroxybenzaldehyde
InChI:
InChI=1S/C7H4Br2O3/c8-4-1-5(11)6(9)7(12)3(4)2-10/h1-2,11-12H
InChI Key:
YKLUXWMWVKYXFX-UHFFFAOYSA-N
SMILES:
O=Cc1c(Br)cc(c(c1O)Br)O
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.851g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
295.914g/mol
Monoisotopic Mass:
293.853g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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