Cas no 19598-01-7 (1H-Inden-1-ol,2-chloro-2,3-dihydro-, (1R,2S)-rel-)
19598-01-7 structure
Product Name:1H-Inden-1-ol,2-chloro-2,3-dihydro-, (1R,2S)-rel-
CAS No:19598-01-7
MF:C9H9ClO
MW:168.620161771774
CID:159363
PubChem ID:279764
Update Time:2025-04-19
1H-Inden-1-ol,2-chloro-2,3-dihydro-, (1R,2S)-rel- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Inden-1-ol,2-chloro-2,3-dihydro-, (1R,2S)-rel-
- (1R,2S)-2-CHLORO-INDAN-1-OL
- 2-chloro-2,3-dihydro-1H-inden-1-ol
- 1-HYDROXY-2-CHLOROINDANE,CIS ISOMER
- trans-2-chlorindan-1-ol
- trans-2-chloroindan-1-ol
- 2-chloroindan-1-ol
- SPECS AC-082
- SPECS AC-082/25006749
- 1-HYDROXY-2-CHLOROINDANE, CIS ISOMER
- NSC131032
- 19598-01-7
- SCHEMBL8067082
- NSC-131032
- DTXSID90941372
- 2-Chloro-1-indanol
- FT-0773474
- 67864-28-2
-
- Inchi： 1S/C9H9ClO/c10-8-5-6-3-1-2-4-7(6)9(8)11/h1-4,8-9,11H,5H2
- InChI Key： SKUCQUAQEKVSAQ-UHFFFAOYSA-N
- SMILES： ClC1CC2C=CC=CC=2C1O
Computed Properties
- Exact Mass: 168.03400
- Monoisotopic Mass: 168.034
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 149
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.8
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- Density: 1.29
- Boiling Point: 313.5°Cat760mmHg
- Flash Point: 143.4°C
- Refractive Index: 1.604
- PSA: 20.23000
- LogP: 1.88350
1H-Inden-1-ol,2-chloro-2,3-dihydro-, (1R,2S)-rel- Related Literature
-
Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
-
Eunkyung Choi,Minjoo Ryu,Haeri Lee,Ok-Sang Jung Dalton Trans., 2017,46, 4595-4601
-
Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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