ethyl 3-aminothiophene-2-carboxylate

ethyl 3-aminothiophene-2-carboxylate

CAS: 31823-64-0

Formula: C7H9NO2S

SMILES: CCOC(=O)C1=C(N)C=CS1

IUPAC: ethyl 3-aminothiophene-2-carboxylate

InChI: InChI=1S/C7H9NO2S/c1-2-10-7(9)6-5(8)3-4-11-6/h3-4H,2,8H2,1H3

Composition: C (49.11%), H (5.30%), N (8.18%), O (18.69%), S (18.73%)

Molar Mass: 171.21

Atom Count: 20

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	171.035399708
Formal Charge	0
FSP3	0.29
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	VSRVNHPIXCUMIA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.42
Topological Polar Surface Area	52.32
Polarizability	16.44
Ring Count	1
Rotatable Bond Count	3

Suppliers

Life Chemicals USA, Inc.

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	31823-64-0		$39.60-$410.85$39.60$48.51$58.41$128.70$232.65$410.85

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	31823-64-0		$126.10-$2,828.42$126.10$199.24$683.46$2,828.42