200,000+ products from a single source!

sales@angenechem.com

Home > Aldehydes > 82668-20-0

82668-20-0

82668-20-0 | Benzaldehyde,2-chloro-4-hydroxy-3-methoxy-

CAS No: 82668-20-0 Catalog No: AG004WWD MDL No:

Product Description

Catalog Number:
AG004WWD
Chemical Name:
Benzaldehyde,2-chloro-4-hydroxy-3-methoxy-
CAS Number:
82668-20-0
Molecular Formula:
C8H7ClO3
Molecular Weight:
186.5924
IUPAC Name:
2-chloro-4-hydroxy-3-methoxybenzaldehyde
InChI:
InChI=1S/C8H7ClO3/c1-12-8-6(11)3-2-5(4-10)7(8)9/h2-4,11H,1H3
InChI Key:
TZGDDUJFJAZQEB-UHFFFAOYSA-N
SMILES:
COc1c(O)ccc(c1Cl)C=O
NSC Number:
95685

Properties

Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.008g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.591g/mol
Monoisotopic Mass:
186.008g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

© 2019 Angene International Limited. All rights Reserved.