Name: Name:2-methyl-2,3-dihydro-1,4-benzodioxine-2-carboxylic acid
Brand: Angene
SKU: AG01BAPU
Rating: 90 (10 reviews)

2-methyl-2,3-dihydro-1,4-benzodioxine-2-carboxylic acid

CAS No.:

68281-27-6

Catalog Number:

AG01BAPU

Molecular Formula:

C10H10O4

Molecular Weight:

194.1840

Catalog Number:

AG01BAPU

Chemical Name:

2-methyl-2,3-dihydro-1,4-benzodioxine-2-carboxylic acid

CAS Number:

68281-27-6

Molecular Formula:

C10H10O4

Molecular Weight:

194.1840

MDL Number:

MFCD20638764

IUPAC Name:

3-methyl-2H-1,4-benzodioxine-3-carboxylic acid

InChI:

InChI=1S/C10H10O4/c1-10(9(11)12)6-13-7-4-2-3-5-8(7)14-10/h2-5H,6H2,1H3,(H,11,12)

InChI Key:

PNXYEGILYPEDQA-UHFFFAOYSA-N

SMILES:

OC(=O)C1(C)COc2c(O1)cccc2

Complexity:

240

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

194.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

194.186g/mol

Monoisotopic Mass:

194.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5