BRN 1469717

2-ethynyl-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ol

CAS: 31721-91-2

Molecular Formula	`C16H13NO`
Molecular Weight	235.28 g/mol
LogP	2.1
Topological Polar Surface Area	33.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	2
Rotatable Bonds	1
Exact Mass	235.09972
Heavy Atoms	18
Complexity	357.0

Chemical Identifiers

CAS Number	31721-91-2
SMILES	`C#CC1(C2=C(CCC3=CC=CC=C31)N=CC=C2)O`
InChIKey	`CDBZVPAISMFCEH-UHFFFAOYSA-N`

📖 Product Overview

BRN 1469717 (CAS: 31721-91-2) is a chemical compound with molecular formula C16H13NO and molecular weight 235.28 g/mol. Its IUPAC systematic name is 2-ethynyl-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ol. LogP 2.1 Topological Polar Surface Area 33.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 2 Rotatable Bonds 1 Exact Mass 235.09972 Heavy Atoms 18 Complexity 357.0 InChI Key: CDBZVPAISMFCEH-UHFFFAOYSA-N. SMILES: C#CC1(C2=C(CCC3=CC=CC=C31)N=CC=C2)O.

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