Name: Name:6-methyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid
Brand: Angene
SKU: AG01BFNK
Rating: 90 (10 reviews)

6-methyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid

CAS No.:

72914-12-6

Catalog Number:

AG01BFNK

Molecular Formula:

C11H12O3

Molecular Weight:

192.2112

Catalog Number:

AG01BFNK

Chemical Name:

6-methyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid

CAS Number:

72914-12-6

Molecular Formula:

C11H12O3

Molecular Weight:

192.2112

MDL Number:

MFCD10696181

IUPAC Name:

6-methyl-3,4-dihydro-2H-chromene-2-carboxylic acid

InChI:

InChI=1S/C11H12O3/c1-7-2-4-9-8(6-7)3-5-10(14-9)11(12)13/h2,4,6,10H,3,5H2,1H3,(H,12,13)

InChI Key:

PXDGCYQSRSOBOE-UHFFFAOYSA-N

SMILES:

OC(=O)C1CCc2c(O1)ccc(c2)C

Complexity:

227

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