Cas no 7415-70-5 (11-methyl-4,11-diazabicyclo[4.4.1]undecan-3-one)
![11-methyl-4,11-diazabicyclo[4.4.1]undecan-3-one structure](https://ossimg.kuujia.com/scimg/7500/7415-70-5x500.png)
7415-70-5 structure
Product Name:11-methyl-4,11-diazabicyclo[4.4.1]undecan-3-one
CAS No:7415-70-5
MF:C10H18N2O
MW:182.262722492218
CID:979071
PubChem ID:282259
Update Time:2025-04-19
11-methyl-4,11-diazabicyclo[4.4.1]undecan-3-one Chemical and Physical Properties
Names and Identifiers
-
- 11-methyl-4,11-diazabicyclo[4.4.1]undecan-3-one
- 11-methyl-3,11-diaza-bicyclo[4.4.1]undecan-4-one
- 11-Methyl-3,11-diazabicyclo[4.4.1]undecan-4-one
- 11-Methyl-3,11-diaza-bicyclo< 4.4.1> undecan-4-on
- AC1L5W2S
- AC1Q6M60
- AG-J-08045
- AR-1C0510
- CTK5D9426
- NSC135468
- DTXSID00300234
- 7415-70-5
- NSC-135468
- ZBIIIQFQVYILOR-UHFFFAOYSA-N
- 3,11-Diazabicyclo[4.4.1]undecan-4-one, 11-methyl-
- 11-Methyl-3,11-diazabicyclo[4.4.1]undecan-4-one #
-
- Inchi： 1S/C10H18N2O/c1-12-8-4-2-3-5-9(12)7-11-10(13)6-8/h8-9H,2-7H2,1H3,(H,11,13)
- InChI Key： ZBIIIQFQVYILOR-UHFFFAOYSA-N
- SMILES： O=C1CC2CCCCC(CN1)N2C
Computed Properties
- Exact Mass: 182.14204
- Monoisotopic Mass: 182.141913202g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 205
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.6
- Topological Polar Surface Area: 32.3?2
Experimental Properties
- Density: 1.013
- Boiling Point: 341.4°C at 760 mmHg
- Flash Point: 160.3°C
- Refractive Index: 1.482
- PSA: 32.34
11-methyl-4,11-diazabicyclo[4.4.1]undecan-3-one Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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