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Ethylene 1-aziridinepropionate

HCID 20086
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
4128-83-0
Standard SMILES
O=C(CCN1CC1)OCCOC(=O)CCN1CC1
InChIKey
PORWAZNYUPGJIW-UHFFFAOYSA-N
Molecular formula
C12H20N2O4
Average molar mass
256.3 g/mol
Monoisotopic mass
256.14230712

Names & identifiers

Preferred name
Ethylene 1-aziridinepropionate
IUPAC
2-[3-(aziridin-1-yl)propanoyloxy]ethyl 3-(aziridin-1-yl)propanoate

Names & synonyms

1-AZIRIDINEPROPIONIC ACID, ETHYLENE ESTEREthylene 1-aziridinepropionateV5SH1NC5YC4128-83-0NSC-42399DTXSID30194188RefChem:1085189DTXCID40116679MLS002608401NSC 42399Ethanediol, bis(1-aziridinepropionate)BRN 1584692
Show more names
1-Aziridinepropanoic acid, ethylene esterUNII-V5SH1NC5YCSCHEMBL673537CHEMBL1899531HMS3092F05NSC42399SMR001527150ETHYLENE BIS(.BETA.-ETHYLENIMINO)PROPIONATE

Database identifiers

CAS
4128-83-0
PubChem CID
20086
DTXSID
DTXSID30194188
ChEMBL
CHEMBL1899531
UNII
V5SH1NC5YC
Nikkaji
J84.752F

Properties

Computed structural properties

XLogP
-0.5
Topological polar surface area
58.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
18
Formal charge
0
Complexity
270

Related reactions

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Compound notes

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