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102626-20-0 | 1,3,5-Benzenetricarboxaldehyde, 2-chloro-
CAS No: 102626-20-0 Catalog No: AG0007YH MDL No:
Product Description
Catalog Number:
AG0007YH
Chemical Name:
1,3,5-Benzenetricarboxaldehyde, 2-chloro-
CAS Number:
102626-20-0
Molecular Formula:
C9H5ClO3
Molecular Weight:
196.5872
IUPAC Name:
2-chlorobenzene-1,3,5-tricarbaldehyde
InChI:
InChI=1S/C9H5ClO3/c10-9-7(4-12)1-6(3-11)2-8(9)5-13/h1-5H
InChI Key:
IBOHGHWGTHVUEZ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(C=O)c(c(c1)C=O)Cl
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.993g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.586g/mol
Monoisotopic Mass:
195.993g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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