Cas no 187267-99-8 (4-Benzofuranamine,2,7-dimethyl-)
187267-99-8 structure
Product Name:4-Benzofuranamine,2,7-dimethyl-
CAS No:187267-99-8
MF:C10H11NO
MW:161.200442552567
CID:114992
PubChem ID:15272565
Update Time:2025-04-18
4-Benzofuranamine,2,7-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Benzofuranamine,2,7-dimethyl-
- 2,7-dimethyl-1-benzofuran-4-amine
- 4-Benzofuranamine, 2,7-dimethyl-
- 2,7-Dimethylbenzofuran-4-amine
- 187267-99-8
-
- Inchi： 1S/C10H11NO/c1-6-3-4-9(11)8-5-7(2)12-10(6)8/h3-5H,11H2,1-2H3
- InChI Key： RREDJZUSFMRHKG-UHFFFAOYSA-N
- SMILES： O1C(C)=CC2C(=CC=C(C)C1=2)N
Computed Properties
- Exact Mass: 161.08413
- Monoisotopic Mass: 161.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 171
- 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: 39.2?2
Experimental Properties
- PSA: 39.16
4-Benzofuranamine,2,7-dimethyl- 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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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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