1,3-PROPANE DITHIOL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C3H8S2
Molecular Weight	108.226
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,3-PROPANE DITHIOL

SMILES

SCCCS

InChI

InChIKey=ZJLMKPKYJBQJNH-UHFFFAOYSA-N

InChI=1S/C3H8S2/c4-2-1-3-5/h4-5H,1-3H2

HIDE SMILES / InChI

Molecular Formula	C3H8S2
Molecular Weight	108.226
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Show entries

Title	Date	PubMed
Synthesis and evaluation of the cytotoxicity of apoptolidinones A and D.	2008 Jul 4	18543990
2-(4-Nitro-phen-yl)-1,3-dithiane.	2009 Jan 17	21581949
7-Nitro-1,2,3,4-tetra-hydro-naphthalene-1-spiro-2'-(1,3-dithiane).	2009 Jan 17	21581948
2-(Pyrene-1-yl)-1,3-dithiane.	2009 Mar 28	21582599
Tyrosine, cysteine, and S-adenosyl methionine stimulate in vitro [FeFe] hydrogenase activation.	2009 Oct 26	19855833

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Patents

Substance Class	Chemical
Record UNII	R4LUJ82U52
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

1,3-PROPANE DITHIOL

Common Name

English

1,3-PROPANEDITHIOL [FHFI]

Common Name

English

1,3-PROPANEDITHIOL [MI]

Common Name

English

MERCAPTOPROPANETHIOL

Systematic Name

English

1,3-DIMERCAPTOPROPANE

Systematic Name

English

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Classification Tree

Code System

Code

FUNCTIONAL CLASSIFICATION

JECFA EVALUATION

1,3-PROPANEDITHIOL

Showing 1 to 1 of 1 entries

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Code System

Code

Type

Description

FDA UNII

R4LUJ82U52

PRIMARY

PUBCHEM

8013

PRIMARY

ECHA (EC/EINECS)

203-706-9

PRIMARY

EPA CompTox

DTXSID0059376

PRIMARY

MERCK INDEX

m9185

PRIMARY

Merck Index

Showing 1 to 5 of 9 entries

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