(3S,6S)-6-Propyl-3-piperidinol
Basic information
- CAS
140-55-6- Standard SMILES
CCC[C@H]1CC[C@H](O)CN1- InChIKey
BQSAUYXITCMAKS-YUMQZZPRSA-N- Molecular formula
- C8H17NO
- Average molar mass
- 143.23 g/mol
- Monoisotopic mass
- 143.13101417
Overview
Pseudoconhydrine is a citraconoyl group.
Names & identifiers
- Preferred name
- (3S,6S)-6-Propyl-3-piperidinol
- IUPAC
- (3S,6S)-6-propylpiperidin-3-ol
Names & synonyms
Pseudoconhydrine(3S,6S)-6-propylpiperidin-3-ol140-55-690282P2S37DTXSID90161210(3S,6S)-6-Propyl-3-piperidinolRefChem:906075DTXCID0083701(3S-trans)-6-Propyl-3-piperidinolBRN 0080100(+)-PseudoconhydrineAC1L3R7G
Show more names
UNII-90282P2S373-Piperidinol, 6-propyl-, (3S-trans)-.PSI.-CONHYDRINEPSEUDOCONHYDRINE [MI]CHEBI:8603AKOS006348909NS000948333-PIPERIDINOL, 6-PROPYL-, (3S,6S)-
Database identifiers
- CAS
140-55-6- PubChem CID
- 120641
- DTXSID
DTXSID90161210- ChEBI
CHEBI:8603- UNII
- 90282P2S37
- Nikkaji
- J822.172C
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 95.3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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