200,000+ products from a single source!
sales@angenechem.com
34225-81-5 | 3-Methyl-1H-indene-2-carboxylic acid
CAS No: 34225-81-5 Catalog No: AG003JRI MDL No:MFCD00044428
Product Description
Catalog Number:
AG003JRI
Chemical Name:
3-Methyl-1H-indene-2-carboxylic acid
CAS Number:
34225-81-5
Molecular Formula:
C11H10O2
Molecular Weight:
174.1959
MDL Number:
MFCD00044428
IUPAC Name:
3-methyl-1H-indene-2-carboxylic acid
InChI:
InChI=1S/C11H10O2/c1-7-9-5-3-2-4-8(9)6-10(7)11(12)13/h2-5H,6H2,1H3,(H,12,13)
InChI Key:
RONBYWGSEXDEKC-UHFFFAOYSA-N
SMILES:
OC(=O)C1=C(C)c2c(C1)cccc2
EC Number:
251-888-3
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.068g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.199g/mol
Monoisotopic Mass:
174.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.