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10287-53-3

10287-53-3 structural image
Product Name: Ethyl 4-dimethylaminobenzoate
Formula: C11H15NO2
Synonyms: 4-Dimethylaminobenzoic acid ethyl ester;Ethyl 4-dimethylaminobenzoate;Parbenate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description NKRA; Pellets or Large Crystals
Kovats Retention Index 1711
Chemical Classes Plastics & Rubber -> Curing Agents (Aromatic)

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Health Hazard
GHS08

Environment
GHS09
GHS Hazard Statements H411:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P202:Do not handle until all safety precautions have been read and understood.
P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P391:Collect spillage. Hazardous to the aquatic environment
P308+P313:IF exposed or concerned: Get medical advice/attention.
P405:Store locked up.

COMPUTED DESCRIPTORS

Molecular Weight 193.24 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 193.110278721 g/mol
Monoisotopic Mass 193.110278721 g/mol
Topological Polar Surface Area 29.5 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 184
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Parbenate is a benzoate ester that is ethyl benzoate substituted by a dimethylamino group at position 4. It is a benzoate ester, a tertiary amino compound and an ethyl ester.