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Benzoic acid, 3-[(1-methylethyl)amino]-, ethyl ester (9CI)

Benzoic acid, 3-[(1-methylethyl)amino]-, ethyl ester (9CI) structure

CAS No:
658689-17-9
Formula:
C12H17NO2
Chemical Name:
Benzoic acid, 3-[(1-methylethyl)amino]-, ethyl ester (9CI)
Synonyms:
Ethyl 3-(isopropylamino)benzoate;SCHEMBL396078;ethyl 3-(propan-2-ylamino)benzoate;ZINC36804374;AKOS009054982;Benzoic acid, 3-[(1-methylethyl)amino]-, ethyl ester

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Benzoic acid, 3-[(1-methylethyl)amino]-, ethyl ester (9CI) Basic Attributes

Molecular Weight：

207.26888

Exact Mass：

207.126

Characteristics

PSA：

38.3

XLogP3：

3.3

Density：

1.053±0.06 g/cm3(Predicted)

Computed Properties

Molecular Weight:207.27
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:207.125928785
Monoisotopic Mass:207.125928785
Topological Polar Surface Area:38.3
Heavy Atom Count:15
Complexity:204
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Benzoic acid, 3-[(1-methylethyl)amino]-, ethyl ester (9CI)

Basic Attributes
Characteristics
Computed Properties
Learn More Other Chemicals

Benzoic acid, 3-[(1-methylethyl)amino]-, ethyl ester (9CI)

SDS

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