Cas no 919117-10-5 (2-Heptanone, 4-azido-)
2-Heptanone, 4-azido- structure
Product Name:2-Heptanone, 4-azido-
CAS No:919117-10-5
MF:C7H13N3O
MW:155.197621107101
CID:765735
PubChem ID:15948663
Update Time:2025-04-19
2-Heptanone, 4-azido- Chemical and Physical Properties
Names and Identifiers
-
- 2-Heptanone, 4-azido-
- 4-azidoheptan-2-one
- 919117-10-5
- DTXSID90580265
-
- Inchi： 1S/C7H13N3O/c1-3-4-7(9-10-8)5-6(2)11/h7H,3-5H2,1-2H3
- InChI Key： XREQPCDFZWLGDF-UHFFFAOYSA-N
- SMILES： O=C(C)CC(CCC)N=[N+]=[N-]
Computed Properties
- Exact Mass: 155.105862047g/mol
- Monoisotopic Mass: 155.105862047g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 173
- 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: 2.1
- Topological Polar Surface Area: 31.4?2
2-Heptanone, 4-azido- Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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