Cas no 213697-51-9 (Morpholine, 4-(2,5-dimethylphenyl)-)
213697-51-9 structure
Product Name:Morpholine, 4-(2,5-dimethylphenyl)-
CAS No:213697-51-9
MF:C12H17NO
MW:191.269483327866
CID:1400983
PubChem ID:11052463
Update Time:2025-04-20
Morpholine, 4-(2,5-dimethylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Morpholine, 4-(2,5-dimethylphenyl)-
- 4-(2,5-dimethylphenyl)morpholine
- N-(2,5-Dimethylphenyl)morpholine
- 213697-51-9
- HS-3395
- DTXSID60453412
- HBIPKTVFAFMKLO-UHFFFAOYSA-N
- SCHEMBL3885064
-
- Inchi： 1S/C12H17NO/c1-10-3-4-11(2)12(9-10)13-5-7-14-8-6-13/h3-4,9H,5-8H2,1-2H3
- InChI Key： HBIPKTVFAFMKLO-UHFFFAOYSA-N
- SMILES： O1CCN(C2C=C(C)C=CC=2C)CC1
Computed Properties
- Exact Mass: 191.13111
- Monoisotopic Mass: 191.131014166g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 177
- 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: 2.4
- Topological Polar Surface Area: 12.5?2
Experimental Properties
- PSA: 12.47
Morpholine, 4-(2,5-dimethylphenyl)- Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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