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Home > Aldehydes > 697302-70-8
697302-70-8 | Benzaldehyde, 5-bromo-2-hydroxy-3-(phenylmethoxy)-
CAS No: 697302-70-8 Catalog No: AG00681B MDL No:
Product Description
Catalog Number:
AG00681B
Chemical Name:
Benzaldehyde, 5-bromo-2-hydroxy-3-(phenylmethoxy)-
CAS Number:
697302-70-8
Molecular Formula:
C14H11BrO3
Molecular Weight:
307.1393
IUPAC Name:
5-bromo-2-hydroxy-3-phenylmethoxybenzaldehyde
InChI:
InChI=1S/C14H11BrO3/c15-12-6-11(8-16)14(17)13(7-12)18-9-10-4-2-1-3-5-10/h1-8,17H,9H2
InChI Key:
QDFREXKCUIXEIS-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Br)cc(c1O)OCc1ccccc1
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.989g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.143g/mol
Monoisotopic Mass:
305.989g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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