200,000+ products from a single source!
sales@angenechem.com
113787-11-4 | 3,5-Cyclohexadiene-1,2,3-triol, 6-chloro-
CAS No: 113787-11-4 Catalog No: AG0009O3 MDL No:
Product Description
Catalog Number:
AG0009O3
Chemical Name:
3,5-Cyclohexadiene-1,2,3-triol, 6-chloro-
CAS Number:
113787-11-4
Molecular Formula:
C6H7ClO3
Molecular Weight:
162.5710
IUPAC Name:
6-chlorocyclohexa-3,5-diene-1,2,3-triol
InChI:
InChI=1S/C6H7ClO3/c7-3-1-2-4(8)6(10)5(3)9/h1-2,5-6,8-10H
InChI Key:
DVJVBNOIAXYQEQ-UHFFFAOYSA-N
SMILES:
OC1=CC=C(C(C1O)O)Cl
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.008g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
162.569g/mol
Monoisotopic Mass:
162.008g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.