Name: Name:3,3-dimethyl-2,3-dihydro-1-benzofuran-7-carboxylic acid
Brand: Angene
SKU: AG01BG1R
Rating: 90 (10 reviews)

3,3-dimethyl-2,3-dihydro-1-benzofuran-7-carboxylic acid

CAS No.:

133609-87-7

Catalog Number:

AG01BG1R

Molecular Formula:

C11H12O3

Molecular Weight:

192.2112

Catalog Number:

AG01BG1R

Chemical Name:

3,3-dimethyl-2,3-dihydro-1-benzofuran-7-carboxylic acid

CAS Number:

133609-87-7

Molecular Formula:

C11H12O3

Molecular Weight:

192.2112

MDL Number:

MFCD03426825

IUPAC Name:

3,3-dimethyl-2H-1-benzofuran-7-carboxylic acid

InChI:

InChI=1S/C11H12O3/c1-11(2)6-14-9-7(10(12)13)4-3-5-8(9)11/h3-5H,6H2,1-2H3,(H,12,13)

InChI Key:

ZLDFSCLOHGEFAD-UHFFFAOYSA-N

SMILES:

OC(=O)c1cccc2c1OCC2(C)C

Complexity:

247

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

192.079g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

192.214g/mol

Monoisotopic Mass:

192.079g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3