bicyclo[1.1.1]pentane-1-carboxamide

bicyclo[1.1.1]pentane-1-carboxamide

CAS: 107474-98-6

Formula: C6H9NO

SMILES: NC(=O)C12CC(C1)C2

IUPAC: bicyclo[1.1.1]pentane-1-carboxamide

InChI: InChI=1S/C6H9NO/c7-5(8)6-1-4(2-6)3-6/h4H,1-3H2,(H2,7,8)

Composition: C (64.84%), H (8.16%), N (12.60%), O (14.39%)

Molar Mass: 111.144

Atom Count: 17

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	111.068413914
Formal Charge	0
FSP3	0.83
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	AWXXNEOTLRMFKW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	29.11
Topological Polar Surface Area	43.09
Polarizability	11.55
Ring Count	2
Rotatable Bond Count	1

Suppliers

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Purity	LeadTime	CAS		UnitPrice
97%	<10 Days	107474-98-6		Quote Only

Custom Synthesis. Higher purity available. Multi gram to multi kg