Cas no 6947-07-5 (Cyclohexanecarboxylicacid, 1-hydroxy-, propyl ester)
6947-07-5 structure
Product Name:Cyclohexanecarboxylicacid, 1-hydroxy-, propyl ester
CAS No:6947-07-5
MF:C10H18O3
MW:186.248123645782
CID:525464
PubChem ID:245436
Update Time:2025-04-19
Cyclohexanecarboxylicacid, 1-hydroxy-, propyl ester Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanecarboxylicacid, 1-hydroxy-, propyl ester
- propyl 1-hydroxycyclohexanecarboxylate; NSC57396; AC1L6FVE; AC1Q66MO; CTK5D0050; AR-1L2354; NSC 57396; NSC-57396; AG-J-08485;
- 6947-07-5
- NSC57396
- DTXSID40288724
- propyl 1-hydroxycyclohexanecarboxylate
- NSC-57396
-
- Inchi: 1S/C10H18O3/c1-2-8-13-9(11)10(12)6-4-3-5-7-10/h12H,2-8H2,1H3
- InChI Key: NGVNZVCESYXGTF-UHFFFAOYSA-N
- SMILES: OC1(C(=O)OCCC)CCCCC1
Computed Properties
- Exact Mass: 186.12564
- Monoisotopic Mass: 186.125594432g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 171
- 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: 2
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.53
Cyclohexanecarboxylicacid, 1-hydroxy-, propyl ester Related Literature
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
6947-07-5 (Cyclohexanecarboxylicacid, 1-hydroxy-, propyl ester) Related Products
- 77-93-0(Triethyl citrate)
- 77-94-1(Tributyl citrate)
- 1127-01-1(1-Hydroxycyclohexanecarboxylic Acid Ethyl Ester)
- 63133-75-5(1,2,3-Propanetricarboxylicacid, 2-hydroxy-, 1,2,3-tris(2-methylpropyl) ester)
- 41248-23-1(Ethyl 1-hydroxycyclopentanecarboxylate)
- 36291-32-4(1,2,3-Propanetricarboxylic acid, 2-hydroxy-, monoester with 1,2,3-propanetriol)
- 1587-21-9(Tripropyl 2-Hydroxypropane-1,2,3-tricarboxylate)
- 65277-53-4(1,2,3-Propanetricarboxylicacid, 2-hydroxy-, 1,2,3-tridodecyl ester)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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