(1R,8S,9R)-bicyclo[6.1.0]non-4-yn-9-ylmethyl 2,5-dioxopyrrolidin-1-yl carbonate

(1R,8S,9R)-bicyclo[6.1.0]non-4-yn-9-ylmethyl 2,5-dioxopyrrolidin-1-yl carbonate

CAS: 1493802-77-9

Formula: C15H17NO5

SMILES: [H][C@@]12CCC#CCC[C@]1([H])[C@H]2COC(=O)ON1C(=O)CCC1=O

IUPAC: [(1R,8S,9R)-bicyclo[6.1.0]non-4-yn-9-yl]methyl 2,5-dioxopyrrolidin-1-yl carbonate

InChI: InChI=1S/C15H17NO5/c17-13-7-8-14(18)16(13)21-15(19)20-9-12-10-5-3-1-2-4-6-11(10)12/h10-12H,3-9H2/t10-,11+,12+

Composition: C (61.85%), H (5.88%), N (4.81%), O (27.46%)

Molar Mass: 291.303

Atom Count: 38

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	3
Exact Mass	291.110672651
Formal Charge	0
FSP3	0.67
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	SKTDJYHCSCYLQU-GDNZZTSVSA-N
Lipinski's Rule of Five	1
Molar Refractivity	71.82
Topological Polar Surface Area	72.91
Polarizability	27.94
Ring Count	3
Rotatable Bond Count	5

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