2-(1-Adamantyl)-4-(chloromethyl)-1,3-thiazole
Basic information
- CAS
632300-38-0- Standard SMILES
ClCc1csc(C23CC4CC(CC(C4)C2)C3)n1- InChIKey
ADUVVOVMHYJPLH-UHFFFAOYSA-N- Molecular formula
- C14H18ClNS
- Average molar mass
- 267.8 g/mol
- Monoisotopic mass
- 267.0848484
Names & identifiers
- Preferred name
- 2-(1-Adamantyl)-4-(chloromethyl)-1,3-thiazole
- IUPAC
- 2-(1-adamantyl)-4-(chloromethyl)-1,3-thiazole
- English name
- CHEMBRDG-BB 9070522
- Molecular formula
- C14H18ClNS
- Molecular weight
- 267.82
Names & synonyms
2-(1-adamantyl)-4-(chloromethyl)-1,3-thiazole632300-38-02-(Adamantan-1-yl)-4-(chloromethyl)thiazoleMFCD037655762-(ADAMANTAN-1-YL)-4-(CHLOROMETHYL)-1,3-THIAZOLEthiazole, 4-(chloromethyl)-2-tricyclo[3.3.1.1~3,7~]dec-1-yl-C14H18ClNSDTXSID10394407ALBB-024141AKOS003295653LS-077872-(1-adamantyl)-4-(chloromethyl)thiazole
Show more names
CHEMBRDG-BB 90705224-(Chloromethyl)-2-tricyclo[3.3.1.13,7]dec-1-ylthiazoleThiazole, 4-(chloromethyl)-2-tricyclo[3.3.1.13,7]dec-1-yl-2-(1-adamantyl)-4-(chloromethyl)-1,3-thiazole(SALTDATA: FREE)
DB-191383CS-0322764ST450035782-adamantanyl-4-(chloromethyl)-1,3-thiazoleH34385
Database identifiers
- CAS
632300-38-0- PubChem CID
- 3624367
- DTXSID
DTXSID10394407
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…