2-(5-methyl-4-nitro-1H-pyrazol-1-yl)acetic acid, 95%

Name: 2-(5-methyl-4-nitro-1H-pyrazol-1-yl)acetic acid
Brand: Chempure

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CAS Number

1001611-09-1

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IUPAC name	2-(5-methyl-4-nitropyrazol-1-yl)acetic acid
inchi	InChI=1S/C6H7N3O4/c1-4-5(9(12)13)2-7-8(4)3-6(10)11/h2H,3H2,1H3,(H,10,11)
inchi key	SXPATAJWIBDNQE-UHFFFAOYSA-N
molecular formula	C6H7N3O4
synonyms	1001611-09-1 (5-methyl-4-nitro-1H-pyrazol-1-yl)acetic acid 2-(5-methyl-4-nitro-pyrazol-1-yl)acetic Acid 2-(5-methyl-4-nitro-1H-pyrazol-1-yl)acetic acid (5-Methyl-4-nitro-pyrazol-1-yl)-acetic acid

Computed Properties

Molecular Weight:	185.14 g/mol
XLogP3:	0.2
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	5
Rotatable Bond Count:	2
Exact Mass:	185.04365571 g/mol
Monoisotopic Mass:	185.04365571 g/mol
Topological Polar Surface Area:	101 Å²
Heavy Atom Count:	13
Formal Charge:	0
Complexity:	226
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

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Product No: AX0742

2-(5-methyl-4-nitro-1H-pyrazol-1-yl)acetic acid, 95%

Product No: AX0742

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