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95652-81-6 | 6-Chloro-2-methoxy-pyridine-3-carbaldehyde
CAS No: 95652-81-6 Catalog No: AG00398S MDL No:MFCD11847276
Product Description
Catalog Number:
AG00398S
Chemical Name:
6-Chloro-2-methoxy-pyridine-3-carbaldehyde
CAS Number:
95652-81-6
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
MDL Number:
MFCD11847276
IUPAC Name:
6-chloro-2-methoxypyridine-3-carbaldehyde
InChI:
InChI=1S/C7H6ClNO2/c1-11-7-5(4-10)2-3-6(8)9-7/h2-4H,1H3
InChI Key:
AVBARORPQMEWPR-UHFFFAOYSA-N
SMILES:
COc1nc(Cl)ccc1C=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:
171.009g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.58g/mol
Monoisotopic Mass:
171.009g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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