3-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoic acid, 95%

Name: 3-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoic acid
Brand: Chempure

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CAS Number

1005612-48-5

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IUPAC name	3-(3-methoxy-4-nitropyrazol-1-yl)propanoic acid
inchi	InChI=1S/C7H9N3O5/c1-15-7-5(10(13)14)4-9(8-7)3-2-6(11)12/h4H,2-3H2,1H3,(H,11,12)
inchi key	NVRUFVJPKKJABJ-UHFFFAOYSA-N
molecular formula	C7H9N3O5
synonyms	3-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoic acid 1005612-48-5 3-(3-methoxy-4-nitropyrazol-1-yl)propanoic acid 3-(3-Methoxy-4-nitro-pyrazol-1-yl)-propionic acid BBL038761

Computed Properties

Molecular Weight:	215.16 g/mol
XLogP3:	-0.2
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	6
Rotatable Bond Count:	4
Exact Mass:	215.05422040 g/mol
Monoisotopic Mass:	215.05422040 g/mol
Topological Polar Surface Area:	110 Å²
Heavy Atom Count:	15
Formal Charge:	0
Complexity:	254
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: AX2247

3-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoic acid, 95%

Product No: AX2247

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