Cas no 6314-56-3 ( )
structure
Product Name:
CAS No:6314-56-3
MF:C12H14BrN
MW:252.150262355804
CID:958836
PubChem ID:54602406
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- N-methyl-1-naphthalen-1-ylmethanamine,hydrobromide
- NSC39782
- NSC-39782
- N-Methyl-1-(naphthalen-1-yl)methanamine--hydrogen bromide (1/1)
- DTXSID60713346
- 6314-56-3
-
-
- Inchi： 1S/C12H13N.BrH/c1-13-9-11-7-4-6-10-5-2-3-8-12(10)11;/h2-8,13H,9H2,1H3;1H
- InChI Key： BTARIJACJFHCMB-UHFFFAOYSA-N
- SMILES： Br.N(C)CC1C=CC=C2C=CC=CC=12
Computed Properties
- Exact Mass: 171.10489
- Monoisotopic Mass: 251.03096g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 155
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 12?2
Experimental Properties
- PSA: 12.03
- LogP: 3.90820
Related Literature
-
Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
-
Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
6314-56-3 ( ) Related Products
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