1,3-Propanedisulfonic acid - CAS 21668-77-9

Catalog:	BB017063
Product Name:	1,3-Propanedisulfonic acid
CAS:	21668-77-9
Synonyms:	propane-1,3-disulfonic acid

Technical Data

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Computed Properties

IUPAC Name:	propane-1,3-disulfonic acid
Description:	1,3-Propanedisulfonic acid (CAS# 21668-77-9) is a useful research chemical.
Molecular Weight:	204.22
Molecular Formula:	C3H8O6S2
Canonical SMILES:	C(CS(=O)(=O)O)CS(=O)(=O)O
InChI:	InChI=1S/C3H8O6S2/c4-10(5,6)2-1-3-11(7,8)9/h1-3H2,(H,4,5,6)(H,7,8,9)
InChI Key:	MGNVWUDMMXZUDI-UHFFFAOYSA-N
Density:	1.773 g/cm³
Appearance:	Liquid
MDL:	MFCD00191482
LogP:	1.31370

Publication Number	Title	Priority Date
WO-2015168315-A1	Use of 1,3-propanedisulfonic acid or pharmaceutically acceptable salts thereof for the treatment of sarcoidosis	20140430
WO-2015110263-A1	Carbazole and carboline compounds for use in the diagnosis, treatment, alleviation or prevention of disorders associated with amyloid or amyolid-like proteins	20140121
EP-2878702-A1	Organic disulfide-containing surface treatment solution for gold or gold alloy plating and method thereof	20131129
US-9080013-B2	Production method for aliphatic polyester	20130722
WO-2014170037-A1	Functional chromium layer with improved corrosion resistance	20130417

PMID	Publication Date	Title	Journal
22197598	20120526	[New trends in the treatment of amyloidosis]	Medicina clinica
22528417	20120301	Counterion condensation in short cationic peptides: limiting mobilities beyond the Onsager-Fuoss theory	Electrophoresis
22427728	20120101	Review of eprodisate for the treatment of renal disease in AA amyloidosis	International journal of nephrology and renovascular disease
21562591	20111201	Preclinical development of siRNA therapeutics for AL amyloidosis	Gene therapy
21360109	20110801	Renal amyloidosis in children	Pediatric nephrology (Berlin, Germany)

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Related Functional Groups

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[85-47-2]
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[2039-96-5]
3-(Trimethylsilyl)-1-propanesulfonic acid sodium salt
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[2170450-99-2]
4-Methyl-1-(phenylsulfonyl)-1H-indole-2-carbonitrile

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GHS Hazard Statement:	H302 (90.48%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (90.48%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]; H332 (90.48%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement:	P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P405, and P501
Signal Word:	Danger

Complexity:	254
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	203.97623032
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	203.97623032
Rotatable Bond Count:	4
Topological Polar Surface Area:	126
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1.6