Basic information
- CAS
6324-09-0- Standard SMILES
O=C(Nc1ncccn1)Oc1ccccc1- InChIKey
WJHUPBKJLWZEAM-UHFFFAOYSA-N- Molecular formula
- C11H9N3O2
- Average molar mass
- 215.21 g/mol
- Monoisotopic mass
- 215.06947653
Names & identifiers
- Preferred name
- Phenyl pyrimidin-2-ylcarbamate
- IUPAC
- phenyl N-pyrimidin-2-ylcarbamate
- English name
- phenyl N-pyrimidin-2-ylcarbamate
- Molecular formula
- C11H9N3O2
- Molecular weight
- 215.21
Names & synonyms
phenyl pyrimidin-2-ylcarbamate6324-09-0NSC30090SCHEMBL896911DTXSID90283148WJHUPBKJLWZEAM-UHFFFAOYSA-NNSC-30090pyrimidin-2-yl-carbamic acid phenyl esterphenyl N-pyrimidin-2-ylcarbamateCarbamic acid, N-2-pyrimidinyl-, phenyl ester
Database identifiers
- CAS
6324-09-0- PubChem CID
- 232522
- DTXSID
DTXSID90283148
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 64.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 223
Physicochemical properties
- Density
- 1.337 · 1.337±0.06 g/cm3(Predicted)
- pka
- 10.42 · 10.42±0.70(Predicted)
Chemistry & industry
Suppliers1 total
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
Related reactions
8 records
Compound notes
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