Cas no 13479-15-7 (heptanedioic acid, sodium salt (1:2))
13479-15-7 structure
Product Name:heptanedioic acid, sodium salt (1:2)
CAS No:13479-15-7
MF:C7H10Na2O4
MW:204.131444454193
CID:1236868
PubChem ID:14525936
Update Time:2025-04-20
heptanedioic acid, sodium salt (1:2) Chemical and Physical Properties
Names and Identifiers
-
- heptanedioic acid, sodium salt (1:2)
- Disodium pimelate
- LogP
- Q27278980
- Disodium heptanedioate
- G9S788RD6E
- UNII-G9S788RD6E
- SCHEMBL6756717
- sodium pimelate
- Pimelic acid, disodium salt
- Sodium pimelate (2:1)
- 13479-15-7
-
- Inchi： 1S/C7H12O4.2Na/c8-6(9)4-2-1-3-5-7(10)11;;/h1-5H2,(H,8,9)(H,10,11);;/q;2*+1/p-2
- InChI Key： IWSNZVQDAUSXPP-UHFFFAOYSA-L
- SMILES： [Na+].[Na+].[O-]C(CCCCCC(=O)[O-])=O
Computed Properties
- Exact Mass: 204.0375
- Monoisotopic Mass: 204.03744736g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 114
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 80.3?2
Experimental Properties
- PSA: 80.26
heptanedioic acid, sodium salt (1:2) Related Literature
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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