Cas no 36875-25-9 (Heptanediimidic acid,1,7-dimethyl ester)
36875-25-9 structure
Product Name:Heptanediimidic acid,1,7-dimethyl ester
CAS No:36875-25-9
MF:C9H18N2O2
MW:186.251422405243
CID:313944
PubChem ID:65403
Update Time:2025-04-19
Heptanediimidic acid,1,7-dimethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Heptanediimidic acid,1,7-dimethyl ester
- dimethyl heptanediimidate
- LS-13703
- 58537-94-3
- NSC 341945
- SCHEMBL43895
- Dimethyl heptane-1,7-diimidate dihydrochloride
- EINECS 261-320-6
- 1,7-dimethyl heptanediimidate
- L9U23Y3EV3
- Heptanediimidic acid, dimethyl ester
- UNII-L9U23Y3EV3
- Q5277319
- Dimethyl pimelimidate
- D92036
- DTXSID80905140
- 36875-25-9
-
- Inchi： 1S/C9H18N2O2/c1-12-8(10)6-4-3-5-7-9(11)13-2/h10-11H,3-7H2,1-2H3
- InChI Key： LRPQMNYCTSPGCX-UHFFFAOYSA-N
- SMILES： O(C)C(CCCCCC(=N)OC)=N
Computed Properties
- Exact Mass: 186.13694
- Monoisotopic Mass: 186.136827821g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 8
- Complexity: 151
- 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: 1.3
- Topological Polar Surface Area: 66.2?2
Experimental Properties
- PSA: 66.16
Heptanediimidic acid,1,7-dimethyl ester Related Literature
-
Glòria Colom,J.-Pablo Salvador,Gerardo Acosta,Fernando Albericio,Miriam Royo,M.-Pilar Marco Analyst 2020 145 6719
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Anke K. Trilling,Jules Beekwilder,Han Zuilhof Analyst 2013 138 1619
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Shi Ying Lim,Wei Shen,Zhiqiang Gao Chem. Soc. Rev. 2015 44 362
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Yoon Ok Jang,Choong Eun Jin,Eun Hwa Choi,Joong Ho Shin,Jihoon Kweon,Bonhan Koo,Seok-Byung Lim,Sei Won Lee,Yong Shin Lab Chip 2019 19 2256
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E. Heiliger,A. Osmanagic,H. Haase,N. Golenhofen,A. M. Grabrucker,A. Weth,W. Baumgartner Metallomics 2015 7 355
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