Name: Name:Acetic acid, 2-(4-chloro-2-methylphenoxy)-, 2-ethylhexyl ester
Brand: Angene
SKU: AG002YFA
Rating: 90 (10 reviews)

Acetic acid, 2-(4-chloro-2-methylphenoxy)-, 2-ethylhexyl ester

CAS No.:

29450-45-1

Catalog Number:

AG002YFA

Molecular Formula:

C17H25ClO3

Molecular Weight:

312.8316

Catalog Number:

AG002YFA

Chemical Name:

Acetic acid, 2-(4-chloro-2-methylphenoxy)-, 2-ethylhexyl ester

CAS Number:

29450-45-1

Molecular Formula:

C17H25ClO3

Molecular Weight:

312.8316

MDL Number:

MFCD00144729

IUPAC Name:

2-ethylhexyl 2-(4-chloro-2-methylphenoxy)acetate

InChI:

InChI=1S/C17H25ClO3/c1-4-6-7-14(5-2)11-21-17(19)12-20-16-9-8-15(18)10-13(16)3/h8-10,14H,4-7,11-12H2,1-3H3

InChI Key:

IDGRPSMONFWWEK-UHFFFAOYSA-N

SMILES:

CCCCC(COC(=O)COc1ccc(cc1C)Cl)CC

EC Number:

249-636-2

Complexity:

296

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

312.149g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

312.834g/mol

Monoisotopic Mass:

312.149g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

35.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.9