Cas no 94749-01-6 (Benzenemethanamine, N-[6-(3-phenylpropoxy)hexyl]-, hydrobromide)
94749-01-6 structure
Product Name:Benzenemethanamine, N-[6-(3-phenylpropoxy)hexyl]-, hydrobromide
CAS No:94749-01-6
MF:C22H32BrNO
MW:406.399585723877
CID:2818310
Update Time:2023-08-07
Benzenemethanamine, N-[6-(3-phenylpropoxy)hexyl]-, hydrobromide Chemical and Physical Properties
Names and Identifiers
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- Benzenemethanamine, N-[6-(3-phenylpropoxy)hexyl]-, hydrobromide
- N-[6-(3-phenylpropoxy)hexyl]benzenemethanamine hydrobromide
- N-Benzyl-6-(3-phenylpropoxy)hexan-1-amine--hydrogen bromide (1/1)
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- Inchi: 1S/C22H31NO.BrH/c1(9-17-23-20-22-14-7-4-8-15-22)2-10-18-24-19-11-16-21-12-5-3-6-13-21;/h3-8,12-15,23H,1-2,9-11,16-20H2;1H
- InChI Key: XHFFNLZNIJAWQJ-UHFFFAOYSA-N
- SMILES: Br.O(CCCC1C=CC=CC=1)CCCCCCNCC1C=CC=CC=1
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 25
- Rotatable Bond Count: 13
- Complexity: 269
- Topological Polar Surface Area: 21.3
Benzenemethanamine, N-[6-(3-phenylpropoxy)hexyl]-, hydrobromide Related Literature
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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