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3391-10-4 | 1-(4-Chlorophenyl)ethanol
CAS No: 3391-10-4 Catalog No: AG003CZ2 MDL No:MFCD00041038
Product Description
Catalog Number:
AG003CZ2
Chemical Name:
1-(4-Chlorophenyl)ethanol
CAS Number:
3391-10-4
Molecular Formula:
C8H9ClO
Molecular Weight:
156.6095
MDL Number:
MFCD00041038
IUPAC Name:
1-(4-chlorophenyl)ethanol
InChI:
InChI=1S/C8H9ClO/c1-6(10)7-2-4-8(9)5-3-7/h2-6,10H,1H3
InChI Key:
MVOSNPUNXINWAD-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)Cl)O
EC Number:
222-223-4
NSC Number:
87867
Properties
Complexity:
97.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.034g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
156.609g/mol
Monoisotopic Mass:
156.034g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| [Broader substrate specifity of Candida parapsilosis SCR II for catalyzing acetophenone derivatives by site-directed mutagenesis]. | Wei sheng wu xue bao = Acta microbiologica Sinica 20110601 |
| Measurement of 60Co high gamma dose using gamma activation of 115 In and 111 Cd foils. | Applied radiation and isotopes : including data, instrumentation and methods for use in agriculture, industry and medicine 20110101 |
| Optimization of culture conditions to produce high yields of active Acetobacter sp. CCTCC M209061 cells for anti-Prelog reduction of prochiral ketones. | BMC biotechnology 20110101 |
| Dose mapping using MCNP code and experiment for SVST-Co-60/B irradiator in Vietnam. | Applied radiation and isotopes : including data, instrumentation and methods for use in agriculture, industry and medicine 20100601 |
| Synthesis of (-)-(S,S)-clemastine by invertive N --> C aryl migration in a lithiated carbamate. | Organic letters 20100521 |
| Substituent effects on the stereochemistry of gas-phase intracomplex nucleophilic substitutions. | Chemistry (Weinheim an der Bergstrasse, Germany) 20061016 |
| Water immiscible ionic liquids as solvents for whole cell biocatalysis. | Journal of biotechnology 20060625 |
| Gamma irradiator dose mapping simulation using the MCNP code and benchmarking with dosimetry. | Applied radiation and isotopes : including data, instrumentation and methods for use in agriculture, industry and medicine 20021001 |
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