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Benzoic acid, 3-[bis(2-chloroethyl)amino]-4-methyl-, methyl ester

Benzoic acid, 3-[bis(2-chloroethyl)amino]-4-methyl-, methyl ester structure

CAS No:
18583-88-5
Formula:
C13H17Cl2NO2
Chemical Name:
Benzoic acid, 3-[bis(2-chloroethyl)amino]-4-methyl-, methyl ester
Synonyms:
3-(N,N-Bis-<2-chlor-ethyl>-amino)-4-methyl-benzoesaeure-methylester; 3-[Bis(2-chloroethyl)amino]-p-toluic acid methyl ester; 3-[Bis(2-chloroethyl)amino]-4-methylbenzoic acid methyl ester;

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Benzoic acid, 3-[bis(2-chloroethyl)amino]-4-methyl-, methyl ester Basic Attributes

Molecular Weight：

290.18600

Exact Mass：

289.0636342 g/mol

NSC Number：

356834

HScode：

2922499990

Characteristics

PSA：

29.54000

XLogP3：

3.06560

Density：

1.222g/cm3

Boiling Point：

401.9ºC

Flash Point：

196.9ºC

Refractive Index：

1.554

Vapor Pressure：

1.14E-06mmHg at 25°C

Computed Properties

Molecular Weight:290.18
XLogP3:3.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:289.0636342
Monoisotopic Mass:289.0636342
Topological Polar Surface Area:29.5
Heavy Atom Count:18
Complexity:257
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Benzoic acid, 3-[bis(2-chloroethyl)amino]-4-methyl-, methyl ester

Basic Attributes
Characteristics
Computed Properties
Learn More Other Chemicals

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