Name: Name:1-(2,3-dihydro-1H-inden-5-yl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde
Brand: Angene
SKU: AG00IDMF
Rating: 90 (10 reviews)

1-(2,3-dihydro-1H-inden-5-yl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde

CAS No.:

852916-94-0

Catalog Number:

AG00IDMF

Molecular Formula:

C16H17NO

Molecular Weight:

239.3123

Catalog Number:

AG00IDMF

Chemical Name:

1-(2,3-dihydro-1H-inden-5-yl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde

CAS Number:

852916-94-0

Molecular Formula:

C16H17NO

Molecular Weight:

239.3123

MDL Number:

MFCD06655752

IUPAC Name:

1-(2,3-dihydro-1H-inden-5-yl)-2,5-dimethylpyrrole-3-carbaldehyde

InChI:

InChI=1S/C16H17NO/c1-11-8-15(10-18)12(2)17(11)16-7-6-13-4-3-5-14(13)9-16/h6-10H,3-5H2,1-2H3

InChI Key:

OMLYKAWORXAFAT-UHFFFAOYSA-N

SMILES:

O=Cc1cc(n(c1C)c1ccc2c(c1)CCC2)C

Complexity:

316

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

239.131g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

239.318g/mol

Monoisotopic Mass:

239.131g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

22A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4