Cas no 7544-54-9 (M-CYMEN-5-AMINE))
M-CYMEN-5-AMINE) structure
Product Name:M-CYMEN-5-AMINE)
CAS No:7544-54-9
MF:C10H15N
MW:149.232802629471
CID:981784
PubChem ID:20616114
Update Time:2025-04-19
M-CYMEN-5-AMINE) Chemical and Physical Properties
Names and Identifiers
-
- 3-methyl-5-propan-2-ylaniline
- 3-Isopropyl-5-methylaniline
- benzenamine, 3-methyl-5-(1-methylethyl)-
- LogP
- AKOS006337191
- 3-Methyl-5-(propan-2-yl)aniline
- SCHEMBL14267832
- 7544-54-9
- GS2751
- DTXSID30609101
- M-CYMEN-5-AMINE)
-
- Inchi： 1S/C10H15N/c1-7(2)9-4-8(3)5-10(11)6-9/h4-7H,11H2,1-3H3
- InChI Key： HQRMXTLFAMXXGD-UHFFFAOYSA-N
- SMILES： NC1C=C(C)C=C(C=1)C(C)C
Computed Properties
- Exact Mass: 149.12055
- Monoisotopic Mass: 149.120449483g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 120
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2.7
- Topological Polar Surface Area: 26?2
Experimental Properties
- PSA: 26.02
M-CYMEN-5-AMINE) Related Literature
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
-
Yuan-Jun Tong,Lu-Dan Yu,Lu-Lu Wu,Shu-Ping Cao,Ru-Ping Liang,Li Zhang,Xing-Hua Xia,Jian-Ding Qiu Chem. Commun., 2018,54, 7487-7490
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
7544-54-9 (M-CYMEN-5-AMINE)) Related Products
- 99-88-7(4-Isopropylaniline)
- 2380-36-1(3,5-Di-tert-butylaniline)
- 587-02-0(3-Ethylaniline)
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- 769-92-6(p-t-Butylaniline)
- 548-61-8(MTA)
- 5369-19-7(3-(tert-Butyl)aniline)
- 5369-16-4(3-Isopropylaniline)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
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