Name: Name:2,2,2-trichloro-1-[1-(thiophen-2-ylmethyl)-1H-pyrrol-2-yl]ethan-1-one
Brand: Angene
SKU: AG01BE9V
Rating: 90 (10 reviews)

2,2,2-trichloro-1-[1-(thiophen-2-ylmethyl)-1H-pyrrol-2-yl]ethan-1-one

CAS No.:

1803589-82-3

Catalog Number:

AG01BE9V

Molecular Formula:

C11H8Cl3NOS

Molecular Weight:

308.6113

Catalog Number:

AG01BE9V

Chemical Name:

2,2,2-trichloro-1-[1-(thiophen-2-ylmethyl)-1H-pyrrol-2-yl]ethan-1-one

CAS Number:

1803589-82-3

Molecular Formula:

C11H8Cl3NOS

Molecular Weight:

308.6113

MDL Number:

MFCD28064031

IUPAC Name:

2,2,2-trichloro-1-[1-(thiophen-2-ylmethyl)pyrrol-2-yl]ethanone

InChI:

InChI=1S/C11H8Cl3NOS/c12-11(13,14)10(16)9-4-1-5-15(9)7-8-3-2-6-17-8/h1-6H,7H2

InChI Key:

QLXQRQZIVQRFEE-UHFFFAOYSA-N

SMILES:

O=C(C(Cl)(Cl)Cl)c1cccn1Cc1cccs1

Complexity:

295

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

306.939g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

308.601g/mol

Monoisotopic Mass:

306.939g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

50.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.8