Name: Name:5-(2,4-DIMETHYLPHENOXY)-2,2-DIMETHYLPENTANOIC ACID
Brand: Angene
SKU: AG008EQM
Rating: 90 (10 reviews)

5-(2,4-DIMETHYLPHENOXY)-2,2-DIMETHYLPENTANOIC ACID

CAS No.:

86837-66-3

Catalog Number:

AG008EQM

Molecular Formula:

C15H22O3

Molecular Weight:

250.3334

Catalog Number:

AG008EQM

Chemical Name:

5-(2,4-DIMETHYLPHENOXY)-2,2-DIMETHYLPENTANOIC ACID

CAS Number:

86837-66-3

Molecular Formula:

C15H22O3

Molecular Weight:

250.3334

MDL Number:

MFCD16327094

IUPAC Name:

5-(2,4-dimethylphenoxy)-2,2-dimethylpentanoic acid

InChI:

InChI=1S/C15H22O3/c1-11-6-7-13(12(2)10-11)18-9-5-8-15(3,4)14(16)17/h6-7,10H,5,8-9H2,1-4H3,(H,16,17)

InChI Key:

STDPGZDKUIITHU-UHFFFAOYSA-N

SMILES:

Cc1ccc(c(c1)C)OCCCC(C(=O)O)(C)C

Complexity:

273

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

250.157g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

250.338g/mol

Monoisotopic Mass:

250.157g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.8