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Details

Stereochemistry ACHIRAL
Molecular Formula C13H14Cl2N2O4
Molecular Weight 333.167
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-Bis(2-chloroethyl)-4-methoxy-2-nitro-7-benzofuranamine

SMILES

COC1=C2C=C(OC2=C(C=C1)N(CCCl)CCCl)[N+]([O-])=O

InChI

InChIKey=VJRUOWDUVMMWOO-UHFFFAOYSA-N
InChI=1S/C13H14Cl2N2O4/c1-20-11-3-2-10(16(6-4-14)7-5-15)13-9(11)8-12(21-13)17(18)19/h2-3,8H,4-7H2,1H3

HIDE SMILES / InChI

Molecular Formula C13H14Cl2N2O4
Molecular Weight 333.167
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:35:14 GMT 2023
Edited
by admin
on Sat Dec 16 09:35:14 GMT 2023
Record UNII
UD3RXJ7QGU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N-Bis(2-chloroethyl)-4-methoxy-2-nitro-7-benzofuranamine
Systematic Name English
7-(Bis(2-chloroethyl)amino)-4-methoxy-2-nitrobenzofuran
Systematic Name English
7-Benzofuranamine, N,N-bis(2-chloroethyl)-4-methoxy-2-nitro-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70148822
Created by admin on Sat Dec 16 09:35:14 GMT 2023 , Edited by admin on Sat Dec 16 09:35:14 GMT 2023
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FDA UNII
UD3RXJ7QGU
Created by admin on Sat Dec 16 09:35:14 GMT 2023 , Edited by admin on Sat Dec 16 09:35:14 GMT 2023
PRIMARY
CAS
109143-18-2
Created by admin on Sat Dec 16 09:35:14 GMT 2023 , Edited by admin on Sat Dec 16 09:35:14 GMT 2023
PRIMARY
PUBCHEM
122986
Created by admin on Sat Dec 16 09:35:14 GMT 2023 , Edited by admin on Sat Dec 16 09:35:14 GMT 2023
PRIMARY