Cas no 148261-92-1 (1,2-Cyclopropanedicarboxylicacid, 1-(1-methylethyl)-, (1R-cis)- (9CI))
148261-92-1 structure
Product Name:1,2-Cyclopropanedicarboxylicacid, 1-(1-methylethyl)-, (1R-cis)- (9CI)
CAS No:148261-92-1
MF:C8H12O4
MW:172.178483009338
CID:100531
PubChem ID:12444591
Update Time:2025-04-18
1,2-Cyclopropanedicarboxylicacid, 1-(1-methylethyl)-, (1R-cis)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Cyclopropanedicarboxylicacid, 1-(1-methylethyl)-, (1R-cis)- (9CI)
- 1,2-Cyclopropanedicarboxylicacid,1-(1-methylethyl)-,(1R-cis)-(9CI)
- 702-88-5
- AKOS027398387
- EN300-703950
- rac-(1R,2R)-1-(propan-2-yl)cyclopropane-1,2-dicarboxylic acid
- (1R,2R)-1-propan-2-ylcyclopropane-1,2-dicarboxylic acid
- Z2896140151
- 148261-92-1
- 1-Isopropylcyclopropane-1alpha,2alpha-dicarboxylic acid
-
- Inchi： 1S/C8H12O4/c1-4(2)8(7(11)12)3-5(8)6(9)10/h4-5H,3H2,1-2H3,(H,9,10)(H,11,12)/t5-,8+/m0/s1
- InChI Key： YCIYREMKVHKNLH-YLWLKBPMSA-N
- SMILES： OC([C@@]1(C(C)C)C[C@H]1C(=O)O)=O
Computed Properties
- Exact Mass: 172.07355886g/mol
- Monoisotopic Mass: 172.07355886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 233
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.6
- Topological Polar Surface Area: 74.6?2
1,2-Cyclopropanedicarboxylicacid, 1-(1-methylethyl)-, (1R-cis)- (9CI) Related Literature
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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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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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
148261-92-1 (1,2-Cyclopropanedicarboxylicacid, 1-(1-methylethyl)-, (1R-cis)- (9CI)) Related Products
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