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Benzoic acid, 4-methyl-, 4-[[(1,1-dimethylethyl)amino]acetyl]-1,2-phenylene ester

Benzoic acid, 4-methyl-, 4-[[(1,1-dimethylethyl)amino]acetyl]-1,2-phenylene ester structure

CAS No:
47749-96-2
Formula:
C28H29NO5
Chemical Name:
Benzoic acid, 4-methyl-, 4-[[(1,1-dimethylethyl)amino]acetyl]-1,2-phenylene ester
Synonyms:
Benzoic acid,4-methyl-,4-[[(1,1-dimethylethyl)amino]acetyl]-1,2-phenylene ester

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Benzoic acid, 4-methyl-, 4-[[(1,1-dimethylethyl)amino]acetyl]-1,2-phenylene ester Basic Attributes

Molecular Weight：

459.53400

Exact Mass：

459.53

EC Number：

256-333-9

DSSTox ID：

DTXSID00197267

Characteristics

PSA：

81.70000

XLogP3：

5.70350

Density：

1.162g/cm3

Boiling Point：

636.2ºC at 760 mmHg

Flash Point：

338.6ºC

Refractive Index：

1.578

Computed Properties

Molecular Weight:459.5
XLogP3:5.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:459.20457303
Monoisotopic Mass:459.20457303
Topological Polar Surface Area:81.7
Heavy Atom Count:34
Complexity:698
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Benzoic acid, 4-methyl-, 4-[[(1,1-dimethylethyl)amino]acetyl]-1,2-phenylene ester

Basic Attributes
Characteristics
Computed Properties
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