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196081-71-7 | 2-Bromo-3-hydroxybenzaldehyde
CAS No: 196081-71-7 Catalog No: AG0037VS MDL No:MFCD00092081
Product Description
Catalog Number:
AG0037VS
Chemical Name:
2-Bromo-3-hydroxybenzaldehyde
CAS Number:
196081-71-7
Molecular Formula:
C7H5BrO2
Molecular Weight:
201.0174
MDL Number:
MFCD00092081
IUPAC Name:
2-bromo-3-hydroxybenzaldehyde
InChI:
InChI=1S/C7H5BrO2/c8-7-5(4-9)2-1-3-6(7)10/h1-4,10H
InChI Key:
OHXPHMPERMIICA-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1Br)O
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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