4-Isopropyltropolone
-
Identifiers
CAS mumber
499-44-5Molecular formula
C10H12O2SMILES
CC(C)C1=CC(=O)C(=CC=C1)O
-
Properties
XLogP3-AA
2.1 Well soluble in DEP, MMB, BBMolecular weight
164.2 g/molMelting points
- 52 - 52.5 °C
Boiling points
- 140.00 °C. @ 10.00 mm Hg
Solubilities
- 1.2 mg/mL at 25 °C
-
Synonyms
- hinokitiol
- 499-44-5
- beta-Thujaplicin
- 4-Isopropyltropolone
- Hinokitol
- beta-Thujaplicine
- Isopropyltropolone
- .beta.-Thujaplicin
- THUJAPLICIN, BETA
- Tropolone, 4-isopropyl-
- beta-Isopropyltropolon
- 2-Hydroxy-4-isopropyl-2,4,6-cycloheptatrien-1-one
- 2,4,6-Cycloheptatrien-1-one, 2-hydroxy-4-(1-methylethyl)-
- 2-Hydroxy-4-isopropylcyclohepta-2,4,6-trien-1-one
- beta-Isopropyltropolone
- NSC 18804
- .beta.-Isopropyltropolon
- 2-Hydroxy-4-(1-methylethyl)-2,4,6-cycloheptatrien-1-one
- EINECS 207-880-7
- 2-hydroxy-6-propan-2-ylcyclohepta-2,4,6-trien-1-one
- .beta.-Thujaplicine
- BRN 2045206
- U5335D6EBI
- CHEBI:10447
- AI3-28398
- 2-hydroxy-4-(propan-2-yl)cyclohepta-2,4,6-trien-1-one
- NSC18804
- 2,4,6-CYCLOHEPTATRIEN-1-ONE, 2-HYDROXY-4-ISOPROPYL-
- 2-Hydroxy-4-isopropyl-2,4,6-cyclohepta-2,4,6-trien-1-one
- MFCD00040180
- NSC-18804
- HINOKITIOL [WHO-DD]
- CHEMBL48310
- MLS001048906
- Hinokitiol 4-Isopropyltropolone
- DTXSID6043911
- .BETA.-THUJAPLICIN [MI]
- 4-08-00-00488 (Beilstein Handbook Reference)
- SMR000387099
- |A-Thujaplicin
- 2-hydroxy-4-isopropyl-cyclohepta2,4,6-trien-1-one
- 2-Hydroxy-4-isopropyl-cyclohepta-2,4,6-trien-1-one
- ?-Thujaplicin
- UNII-U5335D6EBI
- b-Thujaplicin
- |A-thujaplici
- beta -thujaplicin
- beta -thujaplicine
- 6-Isopropyl-tropolon
- Thujaplicin, .beta.
- 2-hydroxy-4-isopropyl- 2,4,6-cycloheptatriene-1-one
- 4-isopropyl-tropolone
- beta -isopropyltropolon
- beta-Thujaplicin, 99%
- 4(6)-Isopropyltropolone
- HINOKITIOL [INCI]
- NCIMech_000141
- cid_3611
- BSPBio_001025
- KBioGR_000365
- KBioSS_000365
- BIDD:ER0491
- SCHEMBL158795
- SPECTRUM1505160
- 2-hydroxy-6-isopropyl-cyclohepta-2,4,6-trien-1-one
- DTXCID4023911
- BDBM79632
- FUWUEFKEXZQKKA-UHFFFAOYSA-
- KBio2_000365
- KBio2_002933
- KBio2_005501
- KBio3_000709
- KBio3_000710
- WLN: L7VJ BQ DY1&1
- Bio2_000343
- Bio2_000823
- GLXC-10286
- HMS1362C07
- HMS1792C07
- HMS1990C07
- HMS2269D23
- HMS3403C07
- HY-B2230
- BBL036671
- BDBM50330794
- CCG-35378
- s4771
- STL559050
- AKOS015895184
- AKOS037515521
- CS-7724
- FH75360
- KS-5297
- IDI1_002098
- QTL1_000044
- NCGC00094565-01
- NCGC00094565-02
- NCGC00094565-03
- NCGC00094565-04
- NCGC00094565-05
- NCGC00179338-01
- NCI60_001565
- SY052139
- DB-051705
- H0142
- NS00003151
- C09904
- C75327
- D04876
- EN300-222362
- beta-Thujaplicin, SAJ special grade, >=99.0%
- 2-Hydroxy-4-isopropyl-2,6-cycloheptatrien-1-one
- 2-Hydroxy-4-isopropyl-cyclohepta-2,4,6-trienone
- SR-01000737397
- 2,6-Cycloheptatrien-1-one, 2-hydroxy-4-isopropyl-
- Q2705171
- SR-01000737397-2
- 2-Hydroxy-4-isopropyl-2,4, 6-cycloheptatrien-1-one
- 2-hydroxy-4-isopropyl-2,4,6-cycloheptatriene-1-one
- BRD-K37691127-001-02-2
- 2-hydroxy-6-propan-2-yl-1-cyclohepta-2,4,6-trienone
- 2-oxidanyl-6-propan-2-yl-cyclohepta-2,4,6-trien-1-one
- Z1255485978
- 2,6-Cycloheptatrien-1-one, 2-hydroxy-4-(1-methylethyl)-
- hydron;7-oxo-5-propan-2-ylcyclohepta-1,3,5-trien-1-olate
- 2-Hydroxy-4(6)-(1-methylethyl)-2,4,6-cycloheptatrien-1-one, 9CI
- InChI=1/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12)
1
/
of
3
Botanical
Name | CAS | Botanical | Proportion |
---|---|---|---|
Star anise (China, Shangyou) 4 | 8007-70-3 | Illicium verum Hooker fil., fam. Magnoliaceae (Illiciaceae) | 0.19% |