200,000+ products from a single source!
sales@angenechem.com
24941-58-0 | 2,5-Cyclohexadiene-1-carboxylic acid, 3,5-dimethoxy-
CAS No: 24941-58-0 Catalog No: AG002PY4 MDL No:
Product Description
Catalog Number:
AG002PY4
Chemical Name:
2,5-Cyclohexadiene-1-carboxylic acid, 3,5-dimethoxy-
CAS Number:
24941-58-0
Molecular Formula:
C9H12O4
Molecular Weight:
184.1892
IUPAC Name:
3,5-dimethoxycyclohexa-2,5-diene-1-carboxylic acid
InChI:
InChI=1S/C9H12O4/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-4,6H,5H2,1-2H3,(H,10,11)
InChI Key:
FSWGOIHYIIOIJR-UHFFFAOYSA-N
SMILES:
COC1=CC(C=C(C1)OC)C(=O)O
NSC Number:
342755
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
184.191g/mol
Monoisotopic Mass:
184.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.