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Structure

3-Bromo-4-isopropoxy-5-methoxybenzonitrile

CAS
515848-62-1
Catalog Number
ACM515848621
Category
Other Products
Molecular Weight
270.13
Molecular Formula
C11H12BrNO2

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Specification

Synonyms
Ambcb9127751, MolPort-000-678-225, ZINC00151911, ALBB-008952, CID735529, STK408908, 3-bromo-4-isopropoxy-5-methoxybenzonitrile, 3-bromo-5-methoxy-4-(propan-2-yloxy)benzonitrile, 515848-62-1
IUPAC Name
3-bromo-5-methoxy-4-propan-2-yloxybenzonitrile
Canonical SMILES
CC(C)OC1=C(C=C(C=C1Br)C#N)OC
InChI Key
DNCFZWKSHFLLGT-UHFFFAOYSA-N
Boiling Point
315.5ºC at 760 mmHg
Flash Point
144.6ºC
Density
1.41g/cm³
Exact Mass
269.00500
H-Bond Acceptor
3
H-Bond Donor
0
Packing Group
III
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