Sodium dimethyldithiocarbamate hydrate

CAT: 0926-FS36455-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0926-FS36455-01Size:25 g

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CAS Number

207233-95-2

MDL Number

MFCD00044839

Smiles

CN (C) C (=S) [S-].O.[Na+]

Molecular Formula

C3H6NNaS2·xH2O

Molecular Weight

143.2 g/mol

Controlled

Chemical Information

Sodium dimethyldithiocarbamate hydrate

CAS Number	207233-95-2
PubChem CID	16218430
IUPAC Name	sodium;N,N-dimethylcarbamodithioate;hydrate
Molecular Formula	C3H8NNaOS2
Molecular Weight	161.23
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	8
Formal Charge	0
Complexity	64

SMILES

CN(C)C(=S)[S-].O.[Na+]

InChI

InChI=1S/C3H7NS2.Na.H2O/c1-4(2)3(5)6;;/h1-2H3,(H,5,6);;1H2/q;+1;/p-1

InChIKey

RJCVAPZBRKHUSV-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 207233-95-2

CID: 16218430

Formula: C3H8NNaOS2

MW: 161.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	161.23
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	160.99450051
Monoisotopic Mass	160.99450051
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	64
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	3
Compound Is Canonicalized	Yes

Catalog	Name
AAA59864-01	Dimethylammonium Dimethyldithiocarbamate
FF39598-01	Faropenem sodium hydrate
KAA10215-01	Sodium sulfite hydrate
FS45995-01	Sodium taurodeoxycholate hydrate
P-6700-01	Sodium phytate hydrate
FS75104-01	Sodium glycocholate hydrate
FS30624-01	Sodium thiophosphate hydrate
ID57913-01	Pantoprazole sodium hydrate
HAA24614	Methicillin sodium hydrate
FS45266-01	Sodium phytate hydrate

Catalog	Name
CS-O-55002	Sodium dimethyldithiocarbamate hydrate
289378-01	Sodium dimethyldithiocarbamate
OR1029802-01	Sodium Dimethyldithiocarbamate Dihydrate
sc-229298	Sodium dimethyldithiocarbamate solution
HY-W098697S	Dimethyldithiocarbamate-d6 (sodium dihydrate)
MBS3841426-01	Sivelestat sodium hydrate (ONO-5046 sodium hydrate)
A16137-25	Sivelestat sodium hydrate (ONO-5046 sodium hydrate) 25mg
A16137-5	Sivelestat sodium hydrate (ONO-5046 sodium hydrate) 5mg
A16137-200	Sivelestat sodium hydrate (ONO-5046 sodium hydrate) 200mg
A16137-100	Sivelestat sodium hydrate (ONO-5046 sodium hydrate) 100mg