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Structure

3-Bromo-5-methoxy-4-propoxybenzonitrile

CAS
515848-04-1
Catalog Number
ACM515848041
Category
Other Products
Molecular Weight
270.12
Molecular Formula
C11H12BrNO2

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Specification

Synonyms
Oprea1_238900, ZINC01792252, AKR-B004820, ALBB-008942, 3-bromo-5-methoxy-4-propoxybenzonitrile, STK408907, CID1580095, 515848-04-1
IUPAC Name
3-bromo-5-methoxy-4-propoxybenzonitrile
Canonical SMILES
CCCOC1=C(C=C(C=C1Br)C#N)OC
InChI Key
PLJGWERCISNRNX-UHFFFAOYSA-N
Boiling Point
321.8ºC at 760 mmHg
Flash Point
148.4ºC
Density
1.41g/cm³
Exact Mass
269.00500
H-Bond Acceptor
3
H-Bond Donor
0
Packing Group
III
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