Cas no 388072-25-1 (Benzoic acid, 3-[(dipropylamino)carbonyl]-5-methyl-)
![Benzoic acid, 3-[(dipropylamino)carbonyl]-5-methyl- structure](https://ossimg.kuujia.com/scimg/388500/388072-25-1x500.png)
388072-25-1 structure
Product Name:Benzoic acid, 3-[(dipropylamino)carbonyl]-5-methyl-
CAS No:388072-25-1
MF:C15H21NO3
MW:263.332144498825
CID:1491048
PubChem ID:11391393
Update Time:2025-04-21
Benzoic acid, 3-[(dipropylamino)carbonyl]-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 3-[(dipropylamino)carbonyl]-5-methyl-
- 3-(dipropylcarbamoyl)-5-methylbenzoic acid
- 388072-25-1
- AKOS027091587
- DTXSID30464474
- DB-086997
- 5-methyl-N,N-dipropyl-isophthalamic acid
- 3-[(Dipropylamino)carbonyl]-5-methylbenzoic acid
- 3-methyl-5-[(dipropylamino)carbonyl]benzoic acid
- SCHEMBL2953707
- 5-methyl-N,N-dipropylisophthalamic acid
- 5-methyl-N, N-dipropylisophthalamic acid
- UCCVUNQWERTTPW-UHFFFAOYSA-N
-
- Inchi： 1S/C15H21NO3/c1-4-6-16(7-5-2)14(17)12-8-11(3)9-13(10-12)15(18)19/h8-10H,4-7H2,1-3H3,(H,18,19)
- InChI Key： UCCVUNQWERTTPW-UHFFFAOYSA-N
- SMILES： O=C(C1C=C(C(=O)O)C=C(C)C=1)N(CCC)CCC
Computed Properties
- Exact Mass: 263.15223
- Monoisotopic Mass: 263.15214353g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 6
- Complexity: 311
- 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: 3.1
- Topological Polar Surface Area: 57.6?2
Experimental Properties
- PSA: 57.61
Benzoic acid, 3-[(dipropylamino)carbonyl]-5-methyl- Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Yu Long,Bing Yuan,Jianrui Niu,Xin Tong,Jiantai Ma New J. Chem., 2015,39, 1179-1185
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N. Soin,D. Boyer,K. Prashanthi,S. Sharma,A. A. Narasimulu,J. Luo,T. H. Shah,E. Siores,T. Thundat Chem. Commun., 2015,51, 8257-8260
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