Basic information
- CAS
13756-48-4- Standard SMILES
CCOC(=O)NCC#N- InChIKey
AHGQESFVDCNOGJ-UHFFFAOYSA-N- Molecular formula
- C5H8N2O2
- Average molar mass
- 128.13 g/mol
- Monoisotopic mass
- 128.0585775
Names & identifiers
- Preferred name
- Carbamic acid, N-(cyanomethyl)-, ethyl ester
- IUPAC
- ethyl N-(cyanomethyl)carbamate
- English name
- ethyl (cyanomethyl)carbamate
- Molecular formula
- C5H8N2O2
- Molecular weight
- 128.12922
Names & synonyms
Ethyl (cyanomethyl)carbamateethyl N-(cyanomethyl)carbamatePR5WV8YTR2ethyl N-cyanomethylcarbamateCarbamic acid, N-(cyanomethyl)-, ethyl esterEINECS 237-343-2DTXSID9065605RefChem:123409DTXCID6034423237-343-213756-48-4Carbamic acid, (cyanomethyl)-, ethyl ester
Show more names
N-ethoxycarbonylamino-acetonitrileCyanomethylcarbamic acid ethyl ester
UNII-PR5WV8YTR2ethoxycarbonylaminoacetonitrileSCHEMBL7523195NS00024466
Database identifiers
- CAS
13756-48-4- PubChem CID
- 83704
- DTXSID
DTXSID9065605- UNII
- PR5WV8YTR2
- EC Number
- 237-343-2
- Nikkaji
- J278.035F
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 62.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 135
Physicochemical properties
- FDA UNII
- 5 WV8YTR2 · PR5WV8YTR2
- EPA Substance Registry System
- Ethyl (cyanomethyl)carbamate (13756-48-4)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationCarbamic acid, N-(cyanomethyl)-, ethyl ester: INACTIVE
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
4 records
Compound notes
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