Iodobenzotef

HCID 197801
NotesReactions

Completing data — usually done within a minute

Substructure searchFind similar structures

Basic information

CAS
4119-81-7
Standard SMILES
O=C(NP(=O)(N1CC1)N1CC1)c1ccccc1I
InChIKey
WLEFRRNVWGUEIP-UHFFFAOYSA-N
Molecular formula
C11H13IN3O2P
Average molar mass
377.12 g/mol
Monoisotopic mass
376.97901129

Overview

RN given refers to (2-iodo)-isomer

Names & identifiers

Preferred name
Iodobenzotef
IUPAC
N-[bis(aziridin-1-yl)phosphoryl]-2-iodobenzamide

Names & synonyms

Iodobenzotef4119-81-7DTXSID20194112N-(Bis(1-aziridinyl)phosphinyl)-2-iodobenzamideRefChem:148517DTXCID30116603N-[bis(aziridin-1-yl)phosphoryl]-2-iodobenzamideo-IodobenzotefBRN 1350293A-103N-(Bis(1-aziridinyl)phosphinyl)-o-iodobenzamideA103
Show more names
96345-59-4Benzamide, N-(bis(1-aziridinyl)phosphinyl)-o-iodo-WLEFRRNVWGUEIP-UHFFFAOYSA-N

Database identifiers

CAS
4119-81-7
PubChem CID
197801
DTXSID
DTXSID20194112
Nikkaji
J68.069I

Properties

Computed structural propertiesFilling in

XLogP
1.1
Topological polar surface area
52.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
18

Related reactions

5 records
New reaction record

Compound notes

Loading…