Ampyrone

CAT: 0127-BUP19389-03Size: 10 gDry Ice: NoHazardous: No

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CAS Number

83-07-8

Synonyms

Minoazophene, Aminoantipyrin, NSC 60242, 4-Aminoantipyrine, Solnapyrin-A

Purity

=98%

Smiles

CS(=O)(=O)N(CC(O)=O)C1=CC(F)=CC=C1

Chemical Information

4-Aminoantipyrine

4-aminoantipyrine is a pyrazolone, a member of the class of pyrazoles that is antipyrine substituted at C-4 by an amino group. It is a metabolite of aminopyrine and of metamizole. It has a role as a non-steroidal anti-inflammatory drug, a non-narcotic analgesic, an antipyretic, an EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor, an antirheumatic drug, a drug metabolite, a peripheral nervous system drug and a marine xenobiotic metabolite. It is a primary amino compound and a pyrazolone. It is functionally related to an antipyrine.

CAS Number	83-07-8
PubChem CID	2151
IUPAC Name	4-amino-1,5-dimethyl-2-phenylpyrazol-3-one
Molecular Formula	C11H13N3O
Molecular Weight	203.24
XLogP	0.1
Topological Polar Surface Area	49.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	15
Formal Charge	0
Complexity	305

SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N

InChI

InChI=1S/C11H13N3O/c1-8-10(12)11(15)14(13(8)2)9-6-4-3-5-7-9/h3-7H,12H2,1-2H3

InChIKey

RLFWWDJHLFCNIJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 83-07-8

CID: 2151

Formula: C11H13N3O

MW: 203.24

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	203.24
XLogP3	0.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	203.105862047
Monoisotopic Mass	203.105862047
Topological Polar Surface Area	49.6 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	305
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

Alternative Products

Catalog	Name
GTR19176522-01	Ampyrone
HY-B1398R-01	Ampyrone (Standard)
HY-B1398S-01	Ampyrone-d3
GTR19241849-01	Ampyrone HCl
69657-01	4-Aminoantipyrine (Ampyrone) PrimeDx, 99%
57432-01	4-Aminoantipyrine (Ampyrone) extrapure AR, 99%

Ampyrone

Chemical Information

Alternative Products

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