Cas no 88562-26-9 (Benzeneacetonitrile,2-bromo-a-oxo-)
88562-26-9 structure
Product Name:Benzeneacetonitrile,2-bromo-a-oxo-
CAS No:88562-26-9
MF:C8H4BrNO
MW:210.027461051941
CID:709816
PubChem ID:12969202
Update Time:2025-04-19
Benzeneacetonitrile,2-bromo-a-oxo- Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetonitrile,2-bromo-a-oxo-
- 2-(2-bromophenyl)-2-oxoacetonitrile
- 2-BROMOBENZOYL CYANIDE
- 2-Brom-benzoylcyanid
- 2-Brom-phenylglyoxylsaeure-nitril
- AB1240
- Benzeneacetonitrile,2-bromo-a-oxo
- o-bromo benzoyl cyanide
- 88562-26-9
- ILFJVILOZNSZQQ-UHFFFAOYSA-N
- SCHEMBL9579742
- 2-Bromobenzene-1-carbonyl cyanide
- DTXSID10514204
- MFCD00193629
- A842707
-
- MDL： MFCD00193629
- Inchi： 1S/C8H4BrNO/c9-7-4-2-1-3-6(7)8(11)5-10/h1-4H
- InChI Key： ILFJVILOZNSZQQ-UHFFFAOYSA-N
- SMILES： BrC1C=CC=CC=1C(C#N)=O
Computed Properties
- Exact Mass: 208.94800
- Monoisotopic Mass: 208.94763g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 205
- 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
- XLogP3: 2.3
- Topological Polar Surface Area: 40.9?2
Experimental Properties
- PSA: 40.86000
- LogP: 2.15538
Benzeneacetonitrile,2-bromo-a-oxo- Customs Data
- HS CODE：2926909090
- Customs Data：
China Customs Code:
2926909090Overview:
2926909090 Other nitrile based compounds. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Summary:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
Benzeneacetonitrile,2-bromo-a-oxo- Related Literature
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
-
Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
-
Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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