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Home > Aldehydes > 102626-21-1
102626-21-1 | 1,3-Benzenedicarboxaldehyde, 4-chloro-5-methyl-
CAS No: 102626-21-1 Catalog No: AG0007YG MDL No:
Product Description
Catalog Number:
AG0007YG
Chemical Name:
1,3-Benzenedicarboxaldehyde, 4-chloro-5-methyl-
CAS Number:
102626-21-1
Molecular Formula:
C9H7ClO2
Molecular Weight:
182.6037
IUPAC Name:
4-chloro-5-methylbenzene-1,3-dicarbaldehyde
InChI:
InChI=1S/C9H7ClO2/c1-6-2-7(4-11)3-8(5-12)9(6)10/h2-5H,1H3
InChI Key:
HEXMENUKPRWRDP-UHFFFAOYSA-N
SMILES:
O=Cc1cc(C=O)c(c(c1)C)Cl
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.013g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.603g/mol
Monoisotopic Mass:
182.013g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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