Cas no 7462-63-7 (2-Butanone,1-methoxy-3-(phenylmethoxy)-)
7462-63-7 structure
Product Name:2-Butanone,1-methoxy-3-(phenylmethoxy)-
CAS No:7462-63-7
MF:C12H16O3
MW:208.253643989563
CID:579702
PubChem ID:344959
Update Time:2025-04-19
2-Butanone,1-methoxy-3-(phenylmethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Butanone,1-methoxy-3-(phenylmethoxy)-
- 1-methoxy-3-phenylmethoxybutan-2-one
- AC1L81QM
- NSC402140
- NSC-402140
- DTXSID80322838
- NSC 402140
- 7462-63-7
-
- Inchi： 1S/C12H16O3/c1-10(12(13)9-14-2)15-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
- InChI Key： IHGZPEIRNFIBOA-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)C(C)C(COC)=O
Computed Properties
- Exact Mass: 208.10998
- Monoisotopic Mass: 208.11
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 6
- Complexity: 185
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- Density: 1.049
- Boiling Point: 313.1°Cat760mmHg
- Flash Point: 134.1°C
- Refractive Index: 1.494
- PSA: 35.53
- LogP: 1.80720
2-Butanone,1-methoxy-3-(phenylmethoxy)- Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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Vanessa dos Santos Pereira Montera,Camila Aparecida Borges Food Funct., 2021,12, 7699-7708
7462-63-7 (2-Butanone,1-methoxy-3-(phenylmethoxy)-) Related Products
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