Basic information
- CAS
76206-37-6- Standard SMILES
CCCN(N=O)C(=O)Oc1cccc2ccccc12- InChIKey
GFGURFSGUIILIB-UHFFFAOYSA-N- Molecular formula
- C14H14N2O3
- Average molar mass
- 258.27 g/mol
- Monoisotopic mass
- 258.10044231
Overview
structure in first source
Names & identifiers
- Preferred name
- 1-naphthyl-N-propyl-N-nitrosocarbamate
- IUPAC
- naphthalen-1-yl N-nitroso-N-propylcarbamate
- English name
- 1-Naphthyl-N-propyl-N-nitrosocarbamate
- Molecular formula
- C14H13N2O3-
- Molecular weight
- 257.26462
Names & synonyms
1-Naphthyl-N-propyl-N-nitrosocarbamate76206-37-6DTXSID90227067Carbamic acid, nitrosopropyl-, 1-naphthalenyl esterRefChem:765431-NPNCBDTXCID90149558N-Nitroso-N-propylcarbamic acid 1-naphthyl ester1-Naphthyl N-propyl-N-nitrosocarbamateCARBAMIC ACID, NITROSOPROPYL-, 1-NAPHTHYL ESTERnaphthalen-1-yl nitroso(propyl)carbamateCarbamic acid,nitrosopropyl-, 1-naphthalenyl ester (9CI)
Database identifiers
- CAS
76206-37-6- PubChem CID
- 53464
- DTXSID
DTXSID90227067- Nikkaji
- J69.373A
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 322
Physicochemical properties
- Boiling point
- 401.53 °C · 401.53°C (rough estimate)
- Density
- 1.1789 · 1.1789 (rough estimate)
- refractive index
- 1.6419 · 1.6419 (estimate)
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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