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1H-pyrazole-4-carbonyl chloride

1H-pyrazole-4-carbonyl chloride

CAS: 103286-53-9

Formula: C4H3ClN2O

SMILES: ClC(=O)C1=CNN=C1

IUPAC: 1H-pyrazole-4-carbonyl chloride

InChI: InChI=1S/C4H3ClN2O/c5-4(8)3-1-6-7-2-3/h1-2H,(H,6,7)

Composition: C (36.81%), H (2.32%), Cl (27.16%), N (21.46%), O (12.26%)

Molar Mass: 130.53

Atom Count: 11

Heavy Atom Count: 8

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 129.9933904
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey KWLGFSHSTADSKH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 30.86
Topological Polar Surface Area 45.75
Polarizability 11.02
Ring Count 1
Rotatable Bond Count 1

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Purity (%)
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Ships Within
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Crea-Chim UAB
Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 103286-53-9 $187.20$187.20
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