Name: Name:methyl 5-(tert-butyl)-4-hydroxy-2-methylbenzoate
Brand: Angene
SKU: AG01DK98
Rating: 90 (10 reviews)

methyl 5-(tert-butyl)-4-hydroxy-2-methylbenzoate

CAS No.:

207737-02-8

Catalog Number:

AG01DK98

Molecular Formula:

C13H18O3

Molecular Weight:

222.2802

Catalog Number:

AG01DK98

Chemical Name:

methyl 5-(tert-butyl)-4-hydroxy-2-methylbenzoate

CAS Number:

207737-02-8

Molecular Formula:

C13H18O3

Molecular Weight:

222.2802

MDL Number:

MFCD31555312

IUPAC Name:

methyl 5-tert-butyl-4-hydroxy-2-methylbenzoate

InChI:

InChI=1S/C13H18O3/c1-8-6-11(14)10(13(2,3)4)7-9(8)12(15)16-5/h6-7,14H,1-5H3

InChI Key:

GZOZJXAZKWJMHP-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc(c(cc1C)O)C(C)(C)C

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

222.126g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

222.284g/mol

Monoisotopic Mass:

222.126g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5