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Home > Aldehydes > 1879026-07-9
1879026-07-9 | 5-chloro-2,6-dimethoxynicotinaldehyde
CAS No: 1879026-07-9 Catalog No: AG01DDYJ MDL No:MFCD29088216
Product Description
Catalog Number:
AG01DDYJ
Chemical Name:
5-chloro-2,6-dimethoxynicotinaldehyde
CAS Number:
1879026-07-9
Molecular Formula:
C8H8ClNO3
Molecular Weight:
201.6070
MDL Number:
MFCD29088216
IUPAC Name:
5-chloro-2,6-dimethoxypyridine-3-carbaldehyde
InChI:
InChI=1S/C8H8ClNO3/c1-12-7-5(4-11)3-6(9)8(10-7)13-2/h3-4H,1-2H3
InChI Key:
BLWPGTRSNBITAP-UHFFFAOYSA-N
SMILES:
COc1nc(OC)c(cc1C=O)Cl
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.019g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.606g/mol
Monoisotopic Mass:
201.019g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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