Name: Name:1-(3-chloroprop-1-yn-1-yl)-4-(trifluoromethyl)benzene
Brand: Angene
SKU: AG019TQK
Rating: 90 (10 reviews)

1-(3-chloroprop-1-yn-1-yl)-4-(trifluoromethyl)benzene

CAS No.:

1179099-72-9

Catalog Number:

AG019TQK

Molecular Formula:

C10H6ClF3

Molecular Weight:

218.6028

Catalog Number:

AG019TQK

Chemical Name:

1-(3-chloroprop-1-yn-1-yl)-4-(trifluoromethyl)benzene

CAS Number:

1179099-72-9

Molecular Formula:

C10H6ClF3

Molecular Weight:

218.6028

MDL Number:

MFCD12155704

IUPAC Name:

1-(3-chloroprop-1-ynyl)-4-(trifluoromethyl)benzene

InChI:

InChI=1S/C10H6ClF3/c11-7-1-2-8-3-5-9(6-4-8)10(12,13)14/h3-6H,7H2

InChI Key:

GSBSYEKUCWXCCI-UHFFFAOYSA-N

SMILES:

ClCC#Cc1ccc(cc1)C(F)(F)F

Complexity:

237

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

218.011g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

218.603g/mol

Monoisotopic Mass:

218.011g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

0A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.6