Boc-L-cysteic acid

CAT: 0024-sc-326464ASize: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-326464ASize:5 g

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CAS Number

277316-57-1

Chemical Information

Boc-L-cysteic acid

CAS Number	277316-57-1
PubChem CID	12508765
IUPAC Name	(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfopropanoic acid
Molecular Formula	C8H15NO7S
Molecular Weight	269.27
XLogP	-0.6
Topological Polar Surface Area	138
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Heavy Atom Count	17
Formal Charge	0
Complexity	389

SMILES

CC(C)(C)OC(=O)N[C@@H](CS(=O)(=O)O)C(=O)O

InChI

InChI=1S/C8H15NO7S/c1-8(2,3)16-7(12)9-5(6(10)11)4-17(13,14)15/h5H,4H2,1-3H3,(H,9,12)(H,10,11)(H,13,14,15)/t5-/m0/s1

InChIKey

OBDTYOCDTWYTGV-YFKPBYRVSA-N

Chemical Structure

2D Structure

CAS: 277316-57-1

CID: 12508765

Formula: C8H15NO7S

MW: 269.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	269.27
XLogP3	-0.6
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Exact Mass	269.05692299
Monoisotopic Mass	269.05692299
Topological Polar Surface Area	138 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	389
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-485621	L-Cysteic Acid
sc-327803A	Fmoc-L-cysteic acid
sc-327803	Fmoc-L-cysteic acid
sc-500932	Dansyl-L-cysteic acid
sc-479043	Boc-L-glutamic acid α-amide
sc-293795A	Boc-L-alpha-aminosuberic acid
sc-479043A	Boc-L-glutamic acid α-amide
sc-293795	Boc-L-alpha-aminosuberic acid
sc-229016	PTH-cysteic acid sodium salt
sc-293866	Boc-L-octahydroindole-2-carboxylic acid