CAS 17795-24-3 | L-Cysteine, S-propyl-, S-oxide | CAS Number 17795-24-3

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17795-24-3 | L-Cysteine, S-propyl-, S-oxide

CAS No: 17795-24-3 Catalog No: AG0025NA MDL No:

Product Description

Catalog Number:

AG0025NA

Chemical Name:

L-Cysteine, S-propyl-, S-oxide

CAS Number:

17795-24-3

Molecular Formula:

C6H13NO3S

Molecular Weight:

179.2373

IUPAC Name:

(2R)-2-amino-3-propylsulfinylpropanoic acid

InChI:

InChI=1S/C6H13NO3S/c1-2-3-11(10)4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-,11?/m0/s1

InChI Key:

JZKMSAGUCSIIAH-ITZCMCNPSA-N

SMILES:

CCCS(=O)C[C@@H](C(=O)O)N

EC Number:

241-772-0

Properties

Complexity:

160

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

179.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

179.234g/mol

Monoisotopic Mass:

179.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

99.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-3.4

Literature

Title	Journal
Chromatographic methods for determination of S-substituted cysteine derivatives--a comparative study.	Journal of chromatography. A 20091009
Biosynthesis of the flavour precursors of onion and garlic.	Journal of experimental botany 20040801
Determination of S-methyl-, S-propyl-, and S-propenyl-L-cysteine sulfoxides by gas chromatography-mass spectrometry after tert-butyldimethylsilylation.	Journal of agricultural and food chemistry 20020731