2-amino-3-(3-methylthiophen-2-yl)propanoic acid

2-amino-3-(3-methylthiophen-2-yl)propanoic acid

Formula: C8H11NO2S

SMILES: CC1=C(CC(N)C(O)=O)SC=C1

IUPAC: 2-amino-3-(3-methylthiophen-2-yl)propanoic acid

InChI: InChI=1/C8H11NO2S/c1-5-2-3-12-7(5)4-6(9)8(10)11/h2-3,6H,4,9H2,1H3,(H,10,11)

Composition: C (51.87%), H (5.99%), N (7.56%), O (17.27%), S (17.31%)

Molar Mass: 185.24

Atom Count: 23

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	185.051049772
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	KGATZGKFEJXZOA-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.16
Topological Polar Surface Area	63.32
Polarizability	18.34
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C8H11NO2S		Quote Only