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N-butylguanidine

N-butylguanidine

CAS: 462-69-1

Formula: C5H13N3

SMILES: CCCCNC(N)=N

IUPAC: N-butylguanidine

InChI: InChI=1S/C5H13N3/c1-2-3-4-8-5(6)7/h2-4H2,1H3,(H4,6,7,8)

Composition: C (52.14%), H (11.38%), N (36.48%)

Molar Mass: 115.18

Atom Count: 21

Heavy Atom Count: 8

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 115.110947431
Formal Charge 0
FSP3 0.8
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey CGWBIHLHAGNJCX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.51
Topological Polar Surface Area 61.9
Polarizability 12.94
Ring Count 0
Rotatable Bond Count 3

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Purity (%)
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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 462-69-1 $235.98-$528.77$235.98$235.98$528.77$528.77
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