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1829-34-1 | Benzaldehyde, 3-bromo-2-hydroxy-
CAS No: 1829-34-1 Catalog No: AG002486 MDL No:MFCD00016587
Product Description
Catalog Number:
AG002486
Chemical Name:
Benzaldehyde, 3-bromo-2-hydroxy-
CAS Number:
1829-34-1
Molecular Formula:
C7H5BrO2
Molecular Weight:
201.0174
MDL Number:
MFCD00016587
IUPAC Name:
3-bromo-2-hydroxybenzaldehyde
InChI:
InChI=1S/C7H5BrO2/c8-6-3-1-2-5(4-9)7(6)10/h1-4,10H
InChI Key:
STBGLXMINLWCNL-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1O)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:
2.3
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