Name: Name:2-chloro-1-[2,5-diMethyl-1-(2-Methylphenyl)-1H-pyrrol-3-yl]ethan-1-one
Brand: Angene
SKU: AG00GUD1
Rating: 90 (10 reviews)

2-chloro-1-[2,5-diMethyl-1-(2-Methylphenyl)-1H-pyrrol-3-yl]ethan-1-one

CAS No.:

923743-10-6

Catalog Number:

AG00GUD1

Molecular Formula:

C15H16ClNO

Molecular Weight:

261.7466

Catalog Number:

AG00GUD1

Chemical Name:

2-chloro-1-[2,5-diMethyl-1-(2-Methylphenyl)-1H-pyrrol-3-yl]ethan-1-one

CAS Number:

923743-10-6

Molecular Formula:

C15H16ClNO

Molecular Weight:

261.7466

MDL Number:

MFCD08444935

IUPAC Name:

2-chloro-1-[2,5-dimethyl-1-(2-methylphenyl)pyrrol-3-yl]ethanone

InChI:

InChI=1S/C15H16ClNO/c1-10-6-4-5-7-14(10)17-11(2)8-13(12(17)3)15(18)9-16/h4-8H,9H2,1-3H3

InChI Key:

QDQJDTSGEOOZQY-UHFFFAOYSA-N

SMILES:

ClCC(=O)c1cc(n(c1C)c1ccccc1C)C

Complexity:

307

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

261.092g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

261.749g/mol

Monoisotopic Mass:

261.092g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

22A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.8