Cas no 68512-06-1 (Benzeneacetaldehyde, reaction products with 2-methylpropanal)
68512-06-1 structure
Product Name:Benzeneacetaldehyde, reaction products with 2-methylpropanal
CAS No:68512-06-1
MF:C12H16O2
MW:192.254243850708
CID:1728705
PubChem ID:172183
Update Time:2025-04-21
Benzeneacetaldehyde, reaction products with 2-methylpropanal Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetaldehyde, reaction products with 2-methylpropanal
- 2-methylpropanal - phenylacetaldehyde (1:1)
- 2-methylpropanal,2-phenylacetaldehyde
- EINECS 270-955-8
- 68512-06-1
-
- Inchi： 1S/C8H8O.C4H8O/c9-7-6-8-4-2-1-3-5-8;1-4(2)3-5/h1-5,7H,6H2;3-4H,1-2H3
- InChI Key： QUIWBQRTXQXIPD-UHFFFAOYSA-N
- SMILES： O=CC(C)C.O=CCC1C=CC=CC=1
Computed Properties
- Exact Mass: 192.115029749g/mol
- Monoisotopic Mass: 192.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 113
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 34.1?2
Benzeneacetaldehyde, reaction products with 2-methylpropanal Related Literature
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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5. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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