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Deanol acetamidobenzoate

Deanol acetamidobenzoate structure

CAS No:
3635-74-3
Formula:
C9H9NO3.C4H11NO
Chemical Name:
Deanol acetamidobenzoate
Synonyms:
Benzoic acid,4-(acetylamino)-,compd. with 2-(dimethylamino)ethanol (1:1);Benzoic acid,p-acetamido-,compd. with 2-(dimethylamino)ethanol (1:1);Benzoic acid,p-acetamido-,compd. with 2-(dimethylamino)ethanol;Ethanol,2-(dimethylamino)-,p-acetamidobenzoate (salt);Ethanol,2-(dimethylamino)-,compd. with p-acetamidobenzoic acid (1:1);Ethanol,2-(dimethylamino)-,4-(acetylamino)benzoate (salt);Deaner;2-(Dimethylamino)ethanol p-acetylaminobenzoate;Deanol acetamidobenzoate;2-Dimethylaminoethanol p-acetamidobenzoate;Diforene;Pabenol;NSC 97399
Categories:
Organic Chemistry > Amides

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Deanol acetamidobenzoate Basic Attributes

Molecular Weight：

268.30900

Exact Mass：

268.14200

EC Number：

222-858-7

UNII：

JSQ17GL1CN

NSC Number：

97399

DSSTox ID：

DTXSID60189880

HScode：

2924299090

Characteristics

PSA：

89.87000

XLogP3：

0.95650

Appearance：

Slightly yelowish powder

Density：

1.0844 (rough estimate)

Melting Point：

159-161.5 °C

Boiling Point：

439.6ºC at 760 mmHg

Flash Point：

219.7ºC

Drug Information

MeSH Entry Terms：

Biminol

Computed Properties

Molecular Weight:268.31
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:268.14230712
Monoisotopic Mass:268.14230712
Topological Polar Surface Area:89.9
Heavy Atom Count:19
Complexity:236
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes