(1H-Pyrrol-2-yl)-acetic acid, 95%

Name: (1H-Pyrrol-2-yl)-acetic acid
Brand: Chempure

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CAS Number

79673-53-3

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About this item

IUPAC name	2-(1H-pyrrol-2-yl)acetic acid
inchi	InChI=1S/C6H7NO2/c8-6(9)4-5-2-1-3-7-5/h1-3,7H,4H2,(H,8,9)
inchi key	GVUHUYQEAGMUNJ-UHFFFAOYSA-N
molecular formula	C6H7NO2
synonyms	2-(1H-pyrrol-2-yl)acetic Acid 79673-53-3 Pyrrole-2-acetic Acid 1H-pyrrol-2-ylacetic acid (1H-Pyrrol-2-yl)-acetic acid

Computed Properties

Molecular Weight:	125.13 g/mol
XLogP3:	0.2
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	2
Exact Mass:	125.047678466 g/mol
Monoisotopic Mass:	125.047678466 g/mol
Topological Polar Surface Area:	53.1 Å²
Heavy Atom Count:	9
Formal Charge:	0
Complexity:	114
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	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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(1H-Pyrrol-2-yl)-acetic acid, 95%

Product No: CO1248

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SAFETY AND HAZARDS

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