Cas no 18998-55-5 (1H-Indole,1-(1,2-propadien-1-yl)-)
18998-55-5 structure
Product Name:1H-Indole,1-(1,2-propadien-1-yl)-
CAS No:18998-55-5
MF:C11H9N
MW:155.195862531662
CID:123293
PubChem ID:11116284
Update Time:2025-04-18
1H-Indole,1-(1,2-propadien-1-yl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole,1-(1,2-propadien-1-yl)-
- 1H-Indole,1-(1,2-propadienyl)-
- 1H-Pyrrole, 2-phenyl-1-(1,2-propadienyl)-
- 1-propadienyl-2-phenylpyrrole
- 1-propadienylindole
- 2-phenyl-1-(1,2-propadienyl)-1H-pyrrole
- ACMC-20mwmc
- CTK0F3546
- 1H-Indole,1-(1,2-propadienyl)-(9CI)
- 18998-55-5
- 1-(1-indolyl)propa-1,2-diene
- AKOS006329949
- 1-propa-1,2-dienylindole
-
- Inchi： 1S/C11H9N/c1-2-8-12-9-7-10-5-3-4-6-11(10)12/h3-9H,1H2
- InChI Key： DYGQCVHHKHFTAE-UHFFFAOYSA-N
- SMILES： N1(C=C=C)C=CC2C=CC=CC1=2
Computed Properties
- Exact Mass: 155.07357
- Monoisotopic Mass: 155.073499291g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 203
- 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: 2.9
- Topological Polar Surface Area: 4.9?2
Experimental Properties
- PSA: 4.93
1H-Indole,1-(1,2-propadien-1-yl)- Related Literature
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Richa Sardessai,Shobhana Krishnaswamy,Mysore S. Shashidhar CrystEngComm, 2012,14, 8010-8016
-
Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
-
R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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