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Home > Aldehydes > 1087659-24-2
1087659-24-2 | 5-Bromo-3-methoxypicolinaldehyde
CAS No: 1087659-24-2 Catalog No: AG00948O MDL No:MFCD11857632
Product Description
Catalog Number:
AG00948O
Chemical Name:
5-Bromo-3-methoxypicolinaldehyde
CAS Number:
1087659-24-2
Molecular Formula:
C7H6BrNO2
Molecular Weight:
216.0320
MDL Number:
MFCD11857632
IUPAC Name:
5-bromo-3-methoxypyridine-2-carbaldehyde
InChI:
InChI=1S/C7H6BrNO2/c1-11-7-2-5(8)3-9-6(7)4-10/h2-4H,1H3
InChI Key:
WJFAWSUSKWTMSS-UHFFFAOYSA-N
SMILES:
COc1cc(Br)cnc1C=O
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.958g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.034g/mol
Monoisotopic Mass:
214.958g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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