Name: Name:Methyl 2-(3-hydroxyprop-1-yn-1-yl);benzoate
Brand: Angene
SKU: AG007G9I
Rating: 90 (10 reviews)

Methyl 2-(3-hydroxyprop-1-yn-1-yl);benzoate

CAS No.:

103606-72-0

Catalog Number:

AG007G9I

Molecular Formula:

C11H10O3

Molecular Weight:

190.1953

Catalog Number:

AG007G9I

Chemical Name:

Methyl 2-(3-hydroxyprop-1-yn-1-yl);benzoate

CAS Number:

103606-72-0

Molecular Formula:

C11H10O3

Molecular Weight:

190.1953

IUPAC Name:

methyl 2-(3-hydroxyprop-1-ynyl)benzoate

InChI:

InChI=1S/C11H10O3/c1-14-11(13)10-7-3-2-5-9(10)6-4-8-12/h2-3,5,7,12H,8H2,1H3

InChI Key:

YSEORDDJWGLYRL-UHFFFAOYSA-N

SMILES:

OCC#Cc1ccccc1C(=O)OC

Complexity:

258

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.198g/mol

Monoisotopic Mass:

190.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9