Compound C13H11ClN2O2

7-chloro-1-methyl-5-prop-2-ynoxy-3H-1,4-benzodiazepin-2-one

CAS: 62903-59-7

Molecular Formula	`C13H11ClN2O2`
Molecular Weight	262.69 g/mol
LogP	1.8
Topological Polar Surface Area	41.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	262.0509
Heavy Atoms	18
Complexity	412.0

Chemical Identifiers

CAS Number	62903-59-7
SMILES	`CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)OCC#C`
InChIKey	`NUIHNVRJVSYJRB-UHFFFAOYSA-N`

📖 Product Overview

Compound C13H11ClN2O2 (CAS: 62903-59-7) is a chemical compound with molecular formula C13H11ClN2O2 and molecular weight 262.69 g/mol. Its IUPAC systematic name is 7-chloro-1-methyl-5-prop-2-ynoxy-3H-1,4-benzodiazepin-2-one. LogP 1.8 Topological Polar Surface Area 41.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 2 Exact Mass 262.0509 Heavy Atoms 18 Complexity 412.0 InChI Key: NUIHNVRJVSYJRB-UHFFFAOYSA-N. SMILES: CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)OCC#C.

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