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Structure

1-Isoquinolinecarbonitrile,2-(3-chloro-1-oxopropyl)-1,2-dihydro-

CAS
32409-95-3
Catalog Number
ACM32409953
Category
Other Products
Molecular Weight
246.69224
Molecular Formula
C13H11ClN2O

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Specification

Synonyms
NSC246968, CID317098, 32409-95-3
IUPAC Name
2-(3-chloropropanoyl)-1H-isoquinoline-1-carbonitrile
Canonical SMILES
C1=CC=C2C(N(C=CC2=C1)C(=O)CCCl)C#N
InChI Key
OVKNQLCXEQHYLH-UHFFFAOYSA-N
Boiling Point
510.8ºC at 760mmHg
Flash Point
262.7ºC
Density
1.3g/cm³
Exact Mass
246.05600
H-Bond Acceptor
2
H-Bond Donor
0
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