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Home > Aldehydes > 199177-26-9
199177-26-9 | Benzaldehyde, 3-bromo-5-hydroxy-
CAS No: 199177-26-9 Catalog No: AG002BXW MDL No:MFCD06797981
Product Description
Catalog Number:
AG002BXW
Chemical Name:
Benzaldehyde, 3-bromo-5-hydroxy-
CAS Number:
199177-26-9
Molecular Formula:
C7H5BrO2
Molecular Weight:
201.0174
MDL Number:
MFCD06797981
IUPAC Name:
3-bromo-5-hydroxybenzaldehyde
InChI:
InChI=1S/C7H5BrO2/c8-6-1-5(4-9)2-7(10)3-6/h1-4,10H
InChI Key:
XVFGERBEZKEGSS-UHFFFAOYSA-N
SMILES:
O=Cc1cc(O)cc(c1)Br
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.947g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.019g/mol
Monoisotopic Mass:
199.947g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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