Name: Name:3-[(tert-butoxy)carbonyl]-5-methylbenzoic acid
Brand: Angene
SKU: AG01C2BN
Rating: 90 (10 reviews)

3-[(tert-butoxy)carbonyl]-5-methylbenzoic acid

CAS No.:

1909308-82-2

Catalog Number:

AG01C2BN

Molecular Formula:

C13H16O4

Molecular Weight:

236.2637

Catalog Number:

AG01C2BN

Chemical Name:

3-[(tert-butoxy)carbonyl]-5-methylbenzoic acid

CAS Number:

1909308-82-2

Molecular Formula:

C13H16O4

Molecular Weight:

236.2637

MDL Number:

MFCD29054942

IUPAC Name:

3-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]benzoic acid

InChI:

InChI=1S/C13H16O4/c1-8-5-9(11(14)15)7-10(6-8)12(16)17-13(2,3)4/h5-7H,1-4H3,(H,14,15)

InChI Key:

CJTACSGWVINDBI-UHFFFAOYSA-N

SMILES:

Cc1cc(cc(c1)C(=O)O)C(=O)OC(C)(C)C

Complexity:

303

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

236.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

236.267g/mol

Monoisotopic Mass:

236.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6