Cas no 103686-54-0 (1-Propanone,2-methyl-1-(5-pyrimidinyl)-)
103686-54-0 structure
Product Name:1-Propanone,2-methyl-1-(5-pyrimidinyl)-
CAS No:103686-54-0
MF:C8H10N2O
MW:150.177801609039
CID:125785
PubChem ID:13645651
Update Time:2025-04-18
1-Propanone,2-methyl-1-(5-pyrimidinyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Propanone,2-methyl-1-(5-pyrimidinyl)-
- 1-Propanone, 2-methyl-1-(5-pyrimidinyl)- (9CI)
- 2-Methyl-1-(5-pyrimidinyl)-1-propanone
- 1-(2-pyridyl)-2-methylpropan-1-one
- 2-(2-methyl-propionyl)pyridine
- 2-methyl-1-(pyrimid-5-yl)-propan-1-one
- 2-Methyl-1-[2]pyridyl-propan-1-on
- 2-methyl-1-[2]pyridyl-propan-1-one
- 2-methyl-1-pyridin-2-yl-propan-1-one
- 2-methyl-1-pyrimidin-5-ylpropan-1-one
- 2-methyl-1-pyrimidin-5-ylpropanone
- AC1L2Q2C
- AC1Q5FZU
- ACMC-1AUKK
- EINECS 261-814-1
- Isopropyl 2-pyridyl ketone
- isopropyl 5-pyrimidinyl ketone
- SureCN888686
- 2-methyl-1-(pyrimidin-5-yl)propan-1-one
- 2-methyl 1(pyrimidin-5-yl)propan-1-one
- 2-methyl-1-(pyrimid-5-yl)-propan- 1-one
- AKOS011779776
- CMQIVPYWPYSREO-UHFFFAOYSA-N
- SCHEMBL1173565
- 103686-54-0
-
- Inchi： 1S/C8H10N2O/c1-6(2)8(11)7-3-9-5-10-4-7/h3-6H,1-2H3
- InChI Key： CMQIVPYWPYSREO-UHFFFAOYSA-N
- SMILES： O=C(C1=CN=CN=C1)C(C)C
Computed Properties
- Exact Mass: 150.0794
- Monoisotopic Mass: 150.079312947g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 139
- 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: 0.9
- Topological Polar Surface Area: 42.8?2
Experimental Properties
- PSA: 42.85
- LogP: 1.31530
1-Propanone,2-methyl-1-(5-pyrimidinyl)- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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