Benzene, 1-tert-butyl-2-chloro-
Basic information
- CAS
7073-98-5- Standard SMILES
CC(C)(C)c1ccccc1Cl- InChIKey
HMRNLPCZVBVKLZ-UHFFFAOYSA-N- Molecular formula
- C10H13Cl
- Average molar mass
- 168.66 g/mol
- Monoisotopic mass
- 168.0705781
Names & identifiers
- Preferred name
- Benzene, 1-tert-butyl-2-chloro-
- IUPAC
- 1-tert-butyl-2-chlorobenzene
Names & synonyms
Benzene, 1-tert-butyl-2-chloro-7073-98-5DTXSID40220987RefChem:323852DTXCID701434781-(tert-butyl)-2-chlorobenzene1-tert-butyl-2-chlorobenzenechloro-t-butylbenzeneSCHEMBL24092SCHEMBL78489SCHEMBL2870874SCHEMBL3092500
Show more names
SCHEMBL3109144SCHEMBL3693169
Database identifiers
- CAS
7073-98-5- PubChem CID
- 138909
- DTXSID
DTXSID40220987- Nikkaji
- J1.510.273J
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 123
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Related reactions
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Compound notes
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