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10401-18-0 | 2-Bromo-3-methoxybenzaldehyde
CAS No: 10401-18-0 Catalog No: AG007F7M MDL No:MFCD09834663
Product Description
Catalog Number:
AG007F7M
Chemical Name:
2-Bromo-3-methoxybenzaldehyde
CAS Number:
10401-18-0
Molecular Formula:
C8H7BrO2
Molecular Weight:
215.0440
MDL Number:
MFCD09834663
IUPAC Name:
2-bromo-3-methoxybenzaldehyde
InChI:
InChI=1S/C8H7BrO2/c1-11-7-4-2-3-6(5-10)8(7)9/h2-5H,1H3
InChI Key:
KELPUINOQGYPKR-UHFFFAOYSA-N
SMILES:
COc1cccc(c1Br)C=O
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.963g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.046g/mol
Monoisotopic Mass:
213.963g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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