Cas no 731-36-2 (2H-Pyrrole, 4-(diphenylmethylene)-3,4-dihydro-5-methyl-)
731-36-2 structure
Product Name:2H-Pyrrole, 4-(diphenylmethylene)-3,4-dihydro-5-methyl-
CAS No:731-36-2
MF:C18H17N
MW:247.334284543991
CID:542968
PubChem ID:12243344
Update Time:2025-04-19
2H-Pyrrole, 4-(diphenylmethylene)-3,4-dihydro-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 2H-Pyrrole, 4-(diphenylmethylene)-3,4-dihydro-5-methyl-
- 3-BENZHYDRYLIDENE-2-METHYL-1-PYRROLINE
- 4-benzhydrylidene-5-methyl-2,3-dihydropyrrole
- DTXSID10482070
- 4-(diphenylmethylene)-5-methyl-3,4-dihydro-2-H-Pyrrole
- 4-(Diphenylmethylidene)-5-methyl-3,4-dihydro-2H-pyrrole
- E83526
- 731-36-2
-
- Inchi: 1S/C18H17N/c1-14-17(12-13-19-14)18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11H,12-13H2,1H3
- InChI Key: IOTANWPGZXCMOF-UHFFFAOYSA-N
- SMILES: N1=C(C)/C(=C(/C2C=CC=CC=2)\C2C=CC=CC=2)/CC1
Computed Properties
- Exact Mass: 247.13621
- Monoisotopic Mass: 247.136099547g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 345
- 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: 4
- Topological Polar Surface Area: 12.4?2
Experimental Properties
- PSA: 12.36
2H-Pyrrole, 4-(diphenylmethylene)-3,4-dihydro-5-methyl- Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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