200,000+ products from a single source!
sales@angenechem.com
29427-69-8 | 1H-Indene-1-carboxylic acid, 2,3-dihydro-3-oxo-
CAS No: 29427-69-8 Catalog No: AG002YCY MDL No:MFCD00092224
Product Description
Catalog Number:
AG002YCY
Chemical Name:
1H-Indene-1-carboxylic acid, 2,3-dihydro-3-oxo-
CAS Number:
29427-69-8
Molecular Formula:
C10H8O3
Molecular Weight:
176.1687
MDL Number:
MFCD00092224
IUPAC Name:
3-oxo-1,2-dihydroindene-1-carboxylic acid
InChI:
InChI=1S/C10H8O3/c11-9-5-8(10(12)13)6-3-1-2-4-7(6)9/h1-4,8H,5H2,(H,12,13)
InChI Key:
HXLJFMRZKCSTQD-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC(=O)c2c1cccc2
NSC Number:
225078
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.047g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.171g/mol
Monoisotopic Mass:
176.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.