 Home > Encyclopedia > 4-[[3-[[4-[bis(2-chloroethyl)amino]phenyl]methyl]-2-(3-fluorophenyl)-1,3-diazinan-1-yl]methyl]-N,N-bis(2-chloroethyl)aniline

4-[[3-[[4-[bis(2-chloroethyl)amino]phenyl]methyl]-2-(3-fluorophenyl)-1,3-diazinan-1-yl]methyl]-N,N-bis(2-chloroethyl)aniline

4-[[3-[[4-[bis(2-chloroethyl)amino]phenyl]methyl]-2-(3-fluorophenyl)-1,3-diazinan-1-yl]methyl]-N,N-bis(2-chloroethyl)aniline structure

CAS No:
16757-49-6
Formula:
C32H39Cl4FN4
Chemical Name:
4-[[3-[[4-[bis(2-chloroethyl)amino]phenyl]methyl]-2-(3-fluorophenyl)-1,3-diazinan-1-yl]methyl]-N,N-bis(2-chloroethyl)aniline
Synonyms:
tetrakis-N-(2-chloro-ethyl)-4,4'-[2-(3-fluoro-phenyl)-dihydro-pyrimidine-1,3-diyldimethyl]-bis-aniline; 2-(3-Fluor-phenyl)-1,3-bis-(4--benzyl)-hexahydropyrimidin;

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4-[[3-[[4-[bis(2-chloroethyl)amino]phenyl]methyl]-2-(3-fluorophenyl)-1,3-diazinan-1-yl]methyl]-N,N-bis(2-chloroethyl)aniline Basic Attributes

Molecular Weight：

640.48900

Exact Mass：

640.188336 g/mol

NSC Number：

94898

DSSTox ID：

DTXSID00329142

Characteristics

PSA：

12.96000

XLogP3：

7.67620

Density：

1.278g/cm3

Boiling Point：

695.9ºC

Flash Point：

374.6ºC

Refractive Index：

1.615

Vapor Pressure：

3.27E-19mmHg at 25°C

Computed Properties

Molecular Weight:640.5
XLogP3:7.8
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:15
Exact Mass:640.188336
Monoisotopic Mass:638.191286
Topological Polar Surface Area:13
Heavy Atom Count:41
Complexity:649
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[[3-[[4-[bis(2-chloroethyl)amino]phenyl]methyl]-2-(3-fluorophenyl)-1,3-diazinan-1-yl]methyl]-N,N-bis(2-chloroethyl)aniline

Basic Attributes
Characteristics
Computed Properties

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