Cis-n-cbz-3-aminocyclopentanecarboxylic acid
Basic information
- CAS
19946-44-2- Standard SMILES
O=C(N[C@H]1CC[C@@H](C(=O)O)C1)OCc1ccccc1- InChIKey
DEHMZYGMZLWARX-NWDGAFQWSA-N- Molecular formula
- C14H17NO4
- Average molar mass
- 263.29 g/mol
- Monoisotopic mass
- 263.11575802
Names & identifiers
- Preferred name
- Cis-n-cbz-3-aminocyclopentanecarboxylic acid
- IUPAC
- cis-(1R,3S)-3-(phenylmethoxycarbonylamino)cyclopentane-1-carboxylic acid
- English name
- cis-N-Cbz-3-aminocyclopentanecarboxylic Acid
- Molecular formula
- C14H17NO4
- Molecular weight
- 263.29
Names & synonyms
19946-44-2Cis-n-cbz-3-aminocyclopentanecarboxylic acidcis-N-Cbz-3-aminocyclopentanecarboxylicAcidcis-3-(benzyloxycarbonylamino)cyclopentanecarboxylic acid(1R,3S)-3-{[(benzyloxy)carbonyl]amino}cyclopentane-1-carboxylic acid196870-66-3(1R,3S)-3-(((benzyloxy)carbonyl)amino)cyclopentane-1-carboxylic acidMFCD31001394rel-(1R,3S)-3-(((Benzyloxy)carbonyl)amino)cyclopentane-1-carboxylic acidUAA94644(1R,3S)-3-(phenylmethoxycarbonylamino)cyclopentane-1-carboxylic acidMFCD31437181
Show more names
rac-(1R,3S)-3-{[(benzyloxy)carbonyl]amino}cyclop entane-1-carboxylic acidCyclopentanecarboxylic acid, 3-[[(phenylmethoxy)carbonyl]amino]-, (1R,3S)-rel-
AKOS037646015AS-65773SY122637CS-0130853EN300-713796EN300-27726958(1R,3S)-3-(benzyloxycarbonylamino)cyclopentanecarboxylic acidcis-3-(benzyloxycarbonylamino)cyclopentanecarboxylic acid - [B84465]
Database identifiers
- CAS
19946-44-2- PubChem CID
- 97030832
- EC Number
- 879-708-4
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 325
Physicochemical properties
- Melting point
- 79 · 79-81 °C
- Boiling point
- 474.4 · 474.4±44.0 °C(Predicted)
- Density
- 1.25 · 1.25±0.1 g/cm3(Predicted)
- pka
- 4.62 · 4.62±0.40(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…