Name: Name:4-[1-(tert-butoxy)-2-methyl-1-oxopropan-2-yl]benzoic acid
Brand: Angene
SKU: AG01EL2H
Rating: 90 (10 reviews)

4-[1-(tert-butoxy)-2-methyl-1-oxopropan-2-yl]benzoic acid

CAS No.:

2138157-80-7

Catalog Number:

AG01EL2H

Molecular Formula:

C15H20O4

Molecular Weight:

264.3169

Catalog Number:

AG01EL2H

Chemical Name:

4-[1-(tert-butoxy)-2-methyl-1-oxopropan-2-yl]benzoic acid

CAS Number:

2138157-80-7

Molecular Formula:

C15H20O4

Molecular Weight:

264.3169

MDL Number:

MFCD31439563

IUPAC Name:

4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]benzoic acid

InChI:

InChI=1S/C15H20O4/c1-14(2,3)19-13(18)15(4,5)11-8-6-10(7-9-11)12(16)17/h6-9H,1-5H3,(H,16,17)

InChI Key:

CTWFWIJVFABQCE-UHFFFAOYSA-N

SMILES:

O=C(C(c1ccc(cc1)C(=O)O)(C)C)OC(C)(C)C

Complexity:

344

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

264.136g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

264.321g/mol

Monoisotopic Mass:

264.136g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2