2-[(2,4-dimethylphenyl)carbamoyl]acetic acid

2-[(2,4-dimethylphenyl)carbamoyl]acetic acid

Formula: C11H13NO3

SMILES: CC1=CC=C(NC(=O)CC(O)=O)C(C)=C1

IUPAC: 2-[(2,4-dimethylphenyl)carbamoyl]acetic acid

InChI: InChI=1S/C11H13NO3/c1-7-3-4-9(8(2)5-7)12-10(13)6-11(14)15/h3-5H,6H2,1-2H3,(H,12,13)(H,14,15)

Composition: C (63.76%), H (6.32%), N (6.76%), O (23.16%)

Molar Mass: 207.229

Atom Count: 28

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	207.089543283
Formal Charge	0
FSP3	0.27
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	BIJQKKGPZNKXKX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.35
Topological Polar Surface Area	66.4
Polarizability	21.12
Ring Count	1
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C11H13NO3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00