SPDH

CAT: 0926-ZXC71879-01Size: 100 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0926-ZXC71879-01Size:100 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

1824718-79-7

Synonyms

N-Succinimidyl-6- (2-pyridyldithio) capronate; LC-SPDP

MDL Number

MFCD28899289

Smiles

C1ccnc (c1) SSCCCCCC (=O) ON2C (=O) CCC2=O

Molecular Formula

C15H18N2O4S2

Molecular Weight

354.44 g/mol

Controlled

Chemical Information

N-Succinimidyl-6-(2-Pyridyldithio)capronate

CAS Number	1824718-79-7
PubChem CID	88596426
IUPAC Name	(2,5-dioxopyrrolidin-1-yl) 6-(pyridin-2-yldisulfanyl)hexanoate
Molecular Formula	C15H18N2O4S2
Molecular Weight	354.4
XLogP	1.7
Topological Polar Surface Area	127
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	10
Heavy Atom Count	23
Formal Charge	0
Complexity	418

SMILES

C1CC(=O)N(C1=O)OC(=O)CCCCCSSC2=CC=CC=N2

InChI

InChI=1S/C15H18N2O4S2/c18-13-8-9-14(19)17(13)21-15(20)7-2-1-5-11-22-23-12-6-3-4-10-16-12/h3-4,6,10H,1-2,5,7-9,11H2

InChIKey

GUNOUNRTBRPXOQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1824718-79-7

CID: 88596426

Formula: C15H18N2O4S2

MW: 354.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	354.4
XLogP3	1.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	10
Exact Mass	354.07079941
Monoisotopic Mass	354.07079941
Topological Polar Surface Area	127 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	418
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
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
T18704-01	SPDH