Name: Name:2-[(4-tert-butylphenyl)methyl]propanedioic acid
Brand: Angene
SKU: AG01A5YP
Rating: 90 (10 reviews)

2-[(4-tert-butylphenyl)methyl]propanedioic acid

CAS No.:

683215-55-6

Catalog Number:

AG01A5YP

Molecular Formula:

C14H18O4

Molecular Weight:

250.2903

Catalog Number:

AG01A5YP

Chemical Name:

2-[(4-tert-butylphenyl)methyl]propanedioic acid

CAS Number:

683215-55-6

Molecular Formula:

C14H18O4

Molecular Weight:

250.2903

MDL Number:

MFCD03966907

IUPAC Name:

2-[(4-tert-butylphenyl)methyl]propanedioic acid

InChI:

InChI=1S/C14H18O4/c1-14(2,3)10-6-4-9(5-7-10)8-11(12(15)16)13(17)18/h4-7,11H,8H2,1-3H3,(H,15,16)(H,17,18)

InChI Key:

RFJKUWQEUIWDBD-UHFFFAOYSA-N

SMILES:

OC(=O)C(C(=O)O)Cc1ccc(cc1)C(C)(C)C

Complexity:

294

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

250.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

250.294g/mol

Monoisotopic Mass:

250.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1