200,000+ products from a single source!
sales@angenechem.com
77186-41-5 | 2-(3,4-Dichlorophenyl);-3-hydroxyacrylonitrile
CAS No: 77186-41-5 Catalog No: AG005DD6 MDL No:MFCD12025879
Product Description
Catalog Number:
AG005DD6
Chemical Name:
2-(3,4-Dichlorophenyl);-3-hydroxyacrylonitrile
CAS Number:
77186-41-5
Molecular Formula:
C9H5Cl2NO
Molecular Weight:
214.0481
MDL Number:
MFCD12025879
IUPAC Name:
(E)-2-(3,4-dichlorophenyl)-3-hydroxyprop-2-enenitrile
InChI:
InChI=1S/C9H5Cl2NO/c10-8-2-1-6(3-9(8)11)7(4-12)5-13/h1-3,5,13H/b7-5-
InChI Key:
RTXZLLOYUZLNBR-ALCCZGGFSA-N
SMILES:
O/C=C(\c1ccc(c(c1)Cl)Cl)/C#N
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
212.975g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.045g/mol
Monoisotopic Mass:
212.975g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.