methyl 3-(2-amino-1,3-thiazol-4-yl)propanoate

methyl 3-(2-amino-1,3-thiazol-4-yl)propanoate

CAS: 436099-75-1

Formula: C7H10N2O2S

SMILES: COC(=O)CCC1=CSC(N)=N1

IUPAC: methyl 3-(2-amino-1,3-thiazol-4-yl)propanoate

InChI: InChI=1S/C7H10N2O2S/c1-11-6(10)3-2-5-4-12-7(8)9-5/h4H,2-3H2,1H3,(H2,8,9)

Composition: C (45.15%), H (5.41%), N (15.04%), O (17.18%), S (17.22%)

Molar Mass: 186.23

Atom Count: 22

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	186.046298744
Formal Charge	0
FSP3	0.43
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	JWDGXHZFNYKFGE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.69
Topological Polar Surface Area	65.21
Polarizability	17.46
Ring Count	1
Rotatable Bond Count	4

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95%	<7 Days	436099-75-1		$97.02-$1,163.25$97.02$173.25$270.27$540.54$810.81$1,163.25

Struchem co.,ltd

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