Name: Name:3-Amino-1,1-dioxo-tetrahydro-1l6-thiophene-3-carboxylic acid
Brand: Angene
SKU: AG00COBS
Rating: 90 (10 reviews)

3-Amino-1,1-dioxo-tetrahydro-1l6-thiophene-3-carboxylic acid

CAS No.:

40057-27-0

Catalog Number:

AG00COBS

Molecular Formula:

C5H9NO4S

Molecular Weight:

179.1943

Catalog Number:

AG00COBS

Chemical Name:

3-Amino-1,1-dioxo-tetrahydro-1l6-thiophene-3-carboxylic acid

CAS Number:

40057-27-0

Molecular Formula:

C5H9NO4S

Molecular Weight:

179.1943

MDL Number:

MFCD11975932

IUPAC Name:

3-amino-1,1-dioxothiolane-3-carboxylic acid

InChI:

InChI=1S/C5H9NO4S/c6-5(4(7)8)1-2-11(9,10)3-5/h1-3,6H2,(H,7,8)

InChI Key:

XEUBUJIFAOGRJM-UHFFFAOYSA-N

SMILES:

OC(=O)C1(N)CCS(=O)(=O)C1

Complexity:

277

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

179.025g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

179.19g/mol

Monoisotopic Mass:

179.025g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

106A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-4