5-carbamoyl-1-methyl-1H-pyrrole-3-sulfonyl chloride, 95%

Name: 5-carbamoyl-1-methyl-1H-pyrrole-3-sulfonyl chloride
Brand: Chempure
Rating: 4 (1 reviews)

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CAS Number

1000931-98-5

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About this item

IUPAC name	5-carbamoyl-1-methylpyrrole-3-sulfonyl chloride
inchi	InChI=1S/C6H7ClN2O3S/c1-9-3-4(13(7,11)12)2-5(9)6(8)10/h2-3H,1H3,(H2,8,10)
inchi key	AXBOCAUMNPHCFS-UHFFFAOYSA-N
molecular formula	C6H7ClN2O3S
synonyms	5-carbamoyl-1-methyl-1H-pyrrole-3-sulfonyl chloride 1000931-98-5 5-(aminocarbonyl)-1-methyl-1H-pyrrole-3-sulfonyl chloride 5-carbamoyl-1-methylpyrrole-3-sulfonyl chloride DTXSID101195039

Computed Properties

Molecular Weight:	222.65 g/mol
XLogP3:	-0.1
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	3
Rotatable Bond Count:	2
Exact Mass:	221.9865910 g/mol
Monoisotopic Mass:	221.9865910 g/mol
Topological Polar Surface Area:	90.5 Å²
Heavy Atom Count:	13
Formal Charge:	0
Complexity:	310
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:	1
Compound Is Canonicalized:	Yes

hazard signal	Danger
hazard classes and categories	Acute Tox. 4 (100%) Skin Corr. 1B (100%) STOT SE 3 (100%)
precautionary statement codes	P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501
hazard statements	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/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: AX0255

5-carbamoyl-1-methyl-1H-pyrrole-3-sulfonyl chloride, 95%

Product No: AX0255

About this item

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Product No: AX0255

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?