Name: Name:2-methyl-2,3-dihydro-1,4-benzodioxine-2-carbonitrile
Brand: Angene
SKU: AG01BXKJ
Rating: 90 (10 reviews)

2-methyl-2,3-dihydro-1,4-benzodioxine-2-carbonitrile

CAS No.:

84141-80-0

Catalog Number:

AG01BXKJ

Molecular Formula:

C10H9NO2

Molecular Weight:

175.1840

Catalog Number:

AG01BXKJ

Chemical Name:

2-methyl-2,3-dihydro-1,4-benzodioxine-2-carbonitrile

CAS Number:

84141-80-0

Molecular Formula:

C10H9NO2

Molecular Weight:

175.1840

MDL Number:

MFCD27929523

IUPAC Name:

3-methyl-2H-1,4-benzodioxine-3-carbonitrile

InChI:

InChI=1S/C10H9NO2/c1-10(6-11)7-12-8-4-2-3-5-9(8)13-10/h2-5H,7H2,1H3

InChI Key:

LIPVUQGTRBXINU-UHFFFAOYSA-N

SMILES:

N#CC1(C)COc2c(O1)cccc2

Complexity:

245

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

175.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

175.187g/mol

Monoisotopic Mass:

175.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6