Cas no 54520-84-2 (2-Pyrrolidinone, 1-methyl-4-phenyl-)
54520-84-2 structure
Product Name:2-Pyrrolidinone, 1-methyl-4-phenyl-
CAS No:54520-84-2
MF:C11H13NO
MW:175.227022886276
CID:354384
PubChem ID:12448963
Update Time:2025-04-19
2-Pyrrolidinone, 1-methyl-4-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyrrolidinone, 1-methyl-4-phenyl-
- 1-methyl-4-phenylpyrrolidin-2-one
- 1-methyl-4-phenyl-2-pyrrolidinone
- 1-Methyl-4-phenyl-pyrrolidin-2-one
- SCHEMBL6556310
- DTXSID40498745
- CHEMBL4788775
- 54520-84-2
- NJSMSOSBMMZSSB-UHFFFAOYSA-N
- BDBM50551475
- N-methyl-4-phenyl-2-pyrrolidone
-
- Inchi： 1S/C11H13NO/c1-12-8-10(7-11(12)13)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3
- InChI Key： NJSMSOSBMMZSSB-UHFFFAOYSA-N
- SMILES： O=C1CC(C2C=CC=CC=2)CN1C
Computed Properties
- Exact Mass: 175.09979
- Monoisotopic Mass: 175.099714038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 196
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.2
- Topological Polar Surface Area: 20.3?2
Experimental Properties
- PSA: 20.31
2-Pyrrolidinone, 1-methyl-4-phenyl- Related Literature
-
Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
54520-84-2 (2-Pyrrolidinone, 1-methyl-4-phenyl-) Related Products
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