Prosulfocarb sulfoxide

CAT: 0862-GW6219-50mgSize: 50 mgDry Ice: NoHazardous: No

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CAT#:0862-GW6219-50mgSize:50 mg

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CAS Number

51954-81-5

Storage Conditions

+4°C

Hazardous Class

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Chemical Information

1-((phenylmethyl)sulfinyl)-N,N-dipropyl-formamide

CAS Number	51954-81-5
PubChem CID	57019542
IUPAC Name	1-benzylsulfinyl-N,N-dipropylformamide
Molecular Formula	C14H21NO2S
Molecular Weight	267.39
XLogP	2.7
Topological Polar Surface Area	56.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	7
Heavy Atom Count	18
Formal Charge	0
Complexity	269

SMILES

CCCN(CCC)C(=O)S(=O)CC1=CC=CC=C1

InChI

InChI=1S/C14H21NO2S/c1-3-10-15(11-4-2)14(16)18(17)12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3

InChIKey

SRUUWJFBIOVZLU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 51954-81-5

CID: 57019542

Formula: C14H21NO2S

MW: 267.39

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	267.39
XLogP3	2.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	7
Exact Mass	267.12930009
Monoisotopic Mass	267.12930009
Topological Polar Surface Area	56.6 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	269
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
GW9252-1g	Prosulfocarb
GW9252-500mg	Prosulfocarb
GK2245-500ml	Dimethyl sulfoxide
GK2245-5l	Dimethyl sulfoxide
GK2245-100ml	Dimethyl sulfoxide
GK2245-1l	Dimethyl sulfoxide
GW3058-1l	Dimethyl sulfoxide, Ph. Eur., USP grade
GW3058-100ml	Dimethyl sulfoxide, Ph. Eur., USP grade
GL9563-500ml	Dimethyl sulfide
GW9967-25mg	Omeprazole sulfide