Acetic acid, 2-(2-bromoallyl)-2-phenyl-, 3-(diethylamino)-2,2-dimethylpropyl ester

[3-(diethylamino)-2,2-dimethylpropyl] 4-bromo-2-phenylpent-4-enoate

CAS: 66827-51-8

Molecular Formula	`C20H30BrNO2`
Molecular Weight	396.4 g/mol
LogP	5.3
Topological Polar Surface Area	29.5 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	11
Exact Mass	395.146
Heavy Atoms	24
Complexity	398.0

Chemical Identifiers

CAS Number	66827-51-8
SMILES	`CCN(CC)CC(C)(C)COC(=O)C(CC(=C)Br)C1=CC=CC=C1`
InChIKey	`ULBPJZCMKCOMJF-UHFFFAOYSA-N`

📖 Product Overview

Acetic acid, 2-(2-bromoallyl)-2-phenyl-, 3-(diethylamino)-2,2-dimethylpropyl ester (CAS: 66827-51-8) is a chemical compound with molecular formula C20H30BrNO2 and molecular weight 396.4 g/mol. Its IUPAC systematic name is [3-(diethylamino)-2,2-dimethylpropyl] 4-bromo-2-phenylpent-4-enoate. LogP 5.3 Topological Polar Surface Area 29.5 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 11 Exact Mass 395.146 Heavy Atoms 24 Complexity 398.0 InChI Key: ULBPJZCMKCOMJF-UHFFFAOYSA-N. SMILES: CCN(CC)CC(C)(C)COC(=O)C(CC(=C)Br)C1=CC=CC=C1.

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