HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

N'-(2-aminoethyl)-N'-(aziridin-1-ylmethyl)ethane-1,2-diamine

HCID 178532064
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
774600-62-3
Standard SMILES
NCCN(CCN)CN1CC1
InChIKey
CHLIWRPPULTWEN-UHFFFAOYSA-N
Molecular formula
C7H18N4
Average molar mass
158.25 g/mol

Names & identifiers

Preferred name
N'-(2-aminoethyl)-N'-(aziridin-1-ylmethyl)ethane-1,2-diamine
IUPAC
N'-(2-aminoethyl)-N'-(aziridin-1-ylmethyl)ethane-1,2-diamine
English name
1,2-Ethanediamine,N-(2-aminoethyl)-N-(1-aziridinylmethyl)-(9CI)
Molecular formula
C7H18N4
Molecular weight
158.24462

Names & synonyms

1,2-Ethanediamine,N-(2-aminoethyl)-N-(1-aziridinylmethyl)-(9CI)

Database identifiers

CAS
774600-62-3

Properties

Computed structural properties

XLogP
-1.7
Topological polar surface area
58.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
11
Formal charge
0
Complexity
96.6

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes