Carbamic acid, (di-2-pyridinylmethyl)-, 1,1-dimethylethyl ester
Basic information
- CAS
167486-55-7- Standard SMILES
CC(C)(C)OC(=O)NC(c1ccccn1)c1ccccn1- InChIKey
BFLAAKWSAKHMMZ-UHFFFAOYSA-N- Molecular formula
- C16H19N3O2
- Average molar mass
- 285.34 g/mol
- Monoisotopic mass
- 285.14772686
Names & identifiers
- Preferred name
- Carbamic acid, (di-2-pyridinylmethyl)-, 1,1-dimethylethyl ester
- IUPAC
- tert-butyl N-(dipyridin-2-ylmethyl)carbamate
Names & synonyms
DTXSID001176337Carbamic acid, (di-2-pyridinylmethyl)-, 1,1-dimethylethyl ester167486-55-7tert-Butyl [di(pyridin-2-yl)methyl]carbamate
Database identifiers
- CAS
167486-55-7- PubChem CID
- 23301596
- DTXSID
DTXSID001176337
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 64.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 323
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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