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825638-07-1 | 2-Propenenitrile, 3-(2-chlorophenyl)-2-formyl-
CAS No: 825638-07-1 Catalog No: AG0053LX MDL No:
Product Description
Catalog Number:
AG0053LX
Chemical Name:
2-Propenenitrile, 3-(2-chlorophenyl)-2-formyl-
CAS Number:
825638-07-1
Molecular Formula:
C10H6ClNO
Molecular Weight:
191.6137
IUPAC Name:
3-(2-chlorophenyl)-2-formylprop-2-enenitrile
InChI:
InChI=1S/C10H6ClNO/c11-10-4-2-1-3-9(10)5-8(6-12)7-13/h1-5,7H
InChI Key:
OAARSSVKTVIMMS-UHFFFAOYSA-N
SMILES:
O=CC(=Cc1ccccc1Cl)C#N
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.014g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.614g/mol
Monoisotopic Mass:
191.014g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2
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