 Home > Encyclopedia > Emetan, 2'-[1-[1-[N,N-bis(2-chloroethyl)glycyl]-L-prolyl]-L-prolyl]-6',7',10,11-tetramethoxy-, dihydrochloride (9CI)

Emetan, 2'-[1-[1-[N,N-bis(2-chloroethyl)glycyl]-L-prolyl]-L-prolyl]-6',7',10,11-tetramethoxy-, dihydrochloride (9CI)

Emetan, 2'-[1-[1-[N,N-bis(2-chloroethyl)glycyl]-L-prolyl]-L-prolyl]-6',7',10,11-tetramethoxy-, dihydrochloride (9CI) structure

CAS No:
16059-31-7
Formula:
C45H64Cl3N5O7
Chemical Name:
Emetan, 2'-[1-[1-[N,N-bis(2-chloroethyl)glycyl]-L-prolyl]-L-prolyl]-6',7',10,11-tetramethoxy-, dihydrochloride (9CI)

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Emetan, 2'-[1-[1-[N,N-bis(2-chloroethyl)glycyl]-L-prolyl]-L-prolyl]-6',7',10,11-tetramethoxy-, dihydrochloride (9CI) Basic Attributes

Molecular Weight：

893.37800

Exact Mass：

891.387132

NSC Number：

106623

DSSTox ID：

DTXSID60637795

Characteristics

PSA：

104.33000

XLogP3：

6.49760

Density：

1.3g/cm3

Boiling Point：

908.7ºC

Flash Point：

503.4ºC

Refractive Index：

1.617

Vapor Pressure：

7.11E-34mmHg at 25°C

Computed Properties

Molecular Weight:893.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:15
Exact Mass:891.387132
Monoisotopic Mass:891.387132
Topological Polar Surface Area:104
Heavy Atom Count:60
Complexity:1410
Undefined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of Emetan, 2'-[1-[1-[N,N-bis(2-chloroethyl)glycyl]-L-prolyl]-L-prolyl]-6',7',10,11-tetramethoxy-, dihydrochloride (9CI)

Basic Attributes
Characteristics
Computed Properties
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