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Structure

4-(Isopropylamino)-3-nitrobenzonitrile

CAS
355022-17-2
Catalog Number
ACM355022172
Category
Other Products
Molecular Weight
205.21
Molecular Formula
C10H11N3O2

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Specification

Synonyms
4-(ISOPROPYLAMINO)-3-NITROBENZONITRILE;BUTTPARK 95\04-37
IUPAC Name
3-nitro-4-(propan-2-ylamino)benzonitrile
Canonical SMILES
CC(C)NC1=C(C=C(C=C1)C#N)[N+](=O)[O-]
InChI Key
UMTOOOMUGFVLDX-UHFFFAOYSA-N
Boiling Point
347.4ºC at 760 mmHg
Melting Point
113ºC
Flash Point
163.9ºC
Density
1.21g/cm³
Exact Mass
205.08500
Hazard Statements
Xn:Harmful;
H-Bond Acceptor
4
H-Bond Donor
1
Safety Description
S36/37
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