Cas no 56276-06-3 (1H-Indole-1-propanol)
1H-Indole-1-propanol structure
Product Name:1H-Indole-1-propanol
CAS No:56276-06-3
MF:C11H13NO
MW:175.227022886276
CID:349337
PubChem ID:15981606
Update Time:2025-04-19
1H-Indole-1-propanol Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole-1-propanol
- 3-indol-1-ylpropan-1-ol
- 3-(1H-indol-1-yl)propan-1-ol
- DTXSID30580603
- AKOS013123971
- 56276-06-3
- SCHEMBL4992403
-
- Inchi： 1S/C11H13NO/c13-9-3-7-12-8-6-10-4-1-2-5-11(10)12/h1-2,4-6,8,13H,3,7,9H2
- InChI Key： BOXDPPLUKGIQLV-UHFFFAOYSA-N
- SMILES： OCCCN1C=CC2C=CC=CC1=2
Computed Properties
- Exact Mass: 175.09979
- Monoisotopic Mass: 175.099714038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 160
- 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: 2.3
- Topological Polar Surface Area: 25.2?2
Experimental Properties
- PSA: 25.16
1H-Indole-1-propanol Related Literature
-
Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
-
Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
-
Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
-
Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
-
Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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