Name: Name:1H-Indene-5-carbonitrile, 2,3-dihydro-4-methoxy-7-methyl-
Brand: Angene
SKU: AG002089
Rating: 90 (10 reviews)

1H-Indene-5-carbonitrile, 2,3-dihydro-4-methoxy-7-methyl-

CAS No.:

175136-10-4

Catalog Number:

AG002089

Molecular Formula:

C12H13NO

Molecular Weight:

187.2377

Catalog Number:

AG002089

Chemical Name:

1H-Indene-5-carbonitrile, 2,3-dihydro-4-methoxy-7-methyl-

CAS Number:

175136-10-4

Molecular Formula:

C12H13NO

Molecular Weight:

187.2377

MDL Number:

MFCD00173681

IUPAC Name:

4-methoxy-7-methyl-2,3-dihydro-1H-indene-5-carbonitrile

InChI:

InChI=1S/C12H13NO/c1-8-6-9(7-13)12(14-2)11-5-3-4-10(8)11/h6H,3-5H2,1-2H3

InChI Key:

SOWLMGGHQDIIQB-UHFFFAOYSA-N

SMILES:

COc1c(C#N)cc(c2c1CCC2)C

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

187.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

187.242g/mol

Monoisotopic Mass:

187.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

33A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8