sodium 3,4-dimethylbenzene-1-sulfinate, 95%

Name: sodium 3,4-dimethylbenzene-1-sulfinate
Brand: Chempure

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CAS Number

1276647-94-9

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About this item

IUPAC name	sodium;3,4-dimethylbenzenesulfinate
inchi	InChI=1S/C8H10O2S.Na/c1-6-3-4-8(11(9)10)5-7(6)2;/h3-5H,1-2H3,(H,9,10);/q;+1/p-1
inchi key	ZNWJXJSZYBZSMD-UHFFFAOYSA-M
molecular formula	C8H9NaO2S
synonyms	sodium 3,4-dimethylbenzene-1-sulfinate 1276647-94-9 sodium;3,4-dimethylbenzenesulfinate SCHEMBL11672586 BBC64794

Computed Properties

Molecular Weight:	192.21 g/mol
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	3
Rotatable Bond Count:	1
Exact Mass:	192.02209498 g/mol
Monoisotopic Mass:	192.02209498 g/mol
Topological Polar Surface Area:	59.3 Å²
Heavy Atom Count:	12
Formal Charge:	0
Complexity:	163
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:	2
Compound Is Canonicalized:	Yes

hazard signal	Warning
hazard classes and categories	Acute Tox. 4 (100%) Skin Irrit. 2 (100%) Eye Irrit. 2A (100%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

Product No: BF1974

sodium 3,4-dimethylbenzene-1-sulfinate, 95%

Product No: BF1974

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Product No: BF1974

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?