Basic information
- CAS
1353970-30-5- Standard SMILES
CN(CC(=O)O)C1CCCCC1NC(=O)OCc1ccccc1- InChIKey
QUSLUAJKBIGKCI-UHFFFAOYSA-N- Molecular formula
- C17H24N2O4
- Average molar mass
- 320.4 g/mol
Names & identifiers
- Preferred name
- [(2-Benzyloxycarbonylamino-cyclohexyl)-methyl-amino]-acetic acid
- IUPAC
- 2-[methyl-[2-(phenylmethoxycarbonylamino)cyclohexyl]amino]acetic acid
- English name
- [(2-BenzyloxycarbonylaMino-cyclohexyl)-Methyl-aMino]-acetic acid
- Molecular formula
- C17H24N2O4
- Molecular weight
- 320.38
Names & synonyms
1353970-30-5[(2-Benzyloxycarbonylamino-cyclohexyl)-methyl-amino]-acetic acid2-((2-(((Benzyloxy)carbonyl)amino)cyclohexyl)(methyl)amino)acetic acidDB-2483582-[[2-(benzyloxycarbonylamino)cyclohexyl]-methyl-amino]acetic acid2-((2-(((Benzyloxy)carbonyl)amino)cyclohexyl)(methyl)amino)aceticacid2-[methyl-[2-(phenylmethoxycarbonylamino)cyclohexyl]amino]acetic acidGlycine, N-methyl-N-[2-[[(phenylmethoxy)carbonyl]amino]cyclohexyl]-
Database identifiers
- CAS
1353970-30-5
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 396
Physicochemical properties
- Boiling point
- 516.7 · 516.7±50.0 °C(Predicted)
- Density
- 1.21 · 1.21±0.1 g/cm3(Predicted)
- pka
- 1.9 · 1.90±0.10(Predicted)
Chemistry & industry
Suppliers1 total
江阴安博生物医药有限公司086-010-62176588 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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