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1H-1,3-benzodiazole-5-carbohydrazide

1H-1,3-benzodiazole-5-carbohydrazide

CAS: 108038-52-4

Formula: C8H8N4O

SMILES: NNC(=O)C1=CC=C2NC=NC2=C1

IUPAC: 1H-1,3-benzodiazole-5-carbohydrazide

InChI: InChI=1S/C8H8N4O/c9-12-8(13)5-1-2-6-7(3-5)11-4-10-6/h1-4H,9H2,(H,10,11)(H,12,13)

Composition: C (54.54%), H (4.58%), N (31.80%), O (9.08%)

Molar Mass: 176.179

Atom Count: 21

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 176.069810894
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey XMKCHQVJPWPSPQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.53
Topological Polar Surface Area 83.8
Polarizability 18.9
Ring Count 2
Rotatable Bond Count 1

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 108038-52-4 $143.75-$2,290.80$143.75$171.35$227.70$343.85$572.70$2,290.80
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