Cas no 6851-36-1 (dl-4-hydroxymandelonitrile)
dl-4-hydroxymandelonitrile structure
Product Name:dl-4-hydroxymandelonitrile
dl-4-hydroxymandelonitrile Chemical and Physical Properties
Names and Identifiers
-
- dl-4-hydroxymandelonitrile
- FT-0693818
- C00650
- DTXSID20926975
- AS-62213
- alpha,4-Dihydroxybenzeneacetonitrile
- D90902
- H0563
- 2-hydroxy-2-(4-hydroxyphenyl)acetonitrile
- MFCD00056685
- 4-hydroxybenzaldehyde cyanonhydrin
- SB84094
- AKOS009158891
- para-Hydroxymandelonitrile
- hydroxy(4-hydroxyphenyl)acetonitrile
- CHEBI:18115
- Benzeneacetonitrile, alpha,4-dihydroxy-
- SCHEMBL467691
- Hydroxy(4-hydroxyphenyl)acetonitrile, AldrichCPR
- CS-0444277
- Q27102830
- 4-Hydroxymandelonitrile
- 13093-65-7
- p-hydroxymandelonitrile
- HOOOPXDSCKBLFG-UHFFFAOYSA-N
- 6851-36-1
- DL-alpha,4-Dihydroxyphenylacetonitrile
- DB-230526
-
- Inchi: 1S/C8H7NO2/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4,8,10-11H
- InChI Key: HOOOPXDSCKBLFG-UHFFFAOYSA-N
- SMILES: OC(C#N)C1C=CC(=CC=1)O
Computed Properties
- Exact Mass: 149.047678466g/mol
- Monoisotopic Mass: 149.047678466g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 274
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 7.7
- Topological Polar Surface Area: 64.2?2
Experimental Properties
- Melting Point: 98°C
dl-4-hydroxymandelonitrile Security Information
- Hazardous Material transportation number:UN 3276
- Hazard Category Code: 20/21/22-36/37/38
- Safety Instruction: 26-36/37/39-36
-
Hazardous Material Identification:
- Risk Phrases:20/21/22
dl-4-hydroxymandelonitrile Related Literature
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
6851-36-1 (dl-4-hydroxymandelonitrile) Related Products
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