Cas no 100252-00-4 (Benzenepropanamine, a-ethyl-4-methoxy-, hydrochloride(1:1))
100252-00-4 structure
Product Name:Benzenepropanamine, a-ethyl-4-methoxy-, hydrochloride(1:1)
CAS No:100252-00-4
MF:C12H20ClNO
MW:229.746302604675
CID:204181
PubChem ID:3063247
Update Time:2025-04-19
Benzenepropanamine, a-ethyl-4-methoxy-, hydrochloride(1:1) Chemical and Physical Properties
Names and Identifiers
-
- Benzenepropanamine, a-ethyl-4-methoxy-, hydrochloride(1:1)
- 1-(4-methoxyphenyl)pentan-3-amine,hydrochloride
- 1-(p-Methoxyphenyl)-3-aminopentane hydrochloride
- 1-Aethyl-3-(4-methoxy-phenyl)-propylamin, Hydrochlorid
- 1-ethyl-3-(4-methoxy-phenyl)-propylamine, hydrochloride
- 1-Ethyl-3-(p-methoxyphenyl)propylamine hydrochloride
- AC1MI5AY
- DO 601
- LS-125691
- Propylamine, 1-ethyl-3-(p-methoxyphenyl)-, hydrochloride
- DO-601
- 1-(4-Methoxyphenyl)pentan-3-amine--hydrogen chloride (1/1)
- 100252-00-4
- starbld0007645
- DTXSID20905301
- DO 601; DO601;1-(p-Methoxyphenyl)-3-aminopentane hydrochloride
- 1-(4-Methoxyphenyl)-3-aminopentane Hydrochloride
- AKOS040751628
- 1-(4-methoxyphenyl)pentan-3-amine hydrochloride
- 1-(4-methoxyphenyl)pentan-3-amine;hydrochloride
-
- Inchi： 1S/C12H19NO.ClH/c1-3-11(13)7-4-10-5-8-12(14-2)9-6-10;/h5-6,8-9,11H,3-4,7,13H2,1-2H3;1H
- InChI Key： KUULRMSUMKVZFY-UHFFFAOYSA-N
- SMILES： Cl.O(C)C1C=CC(=CC=1)CCC(CC)N
Computed Properties
- Exact Mass: 229.1235
- Monoisotopic Mass: 229.123
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 141
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 35.2?2
Experimental Properties
- Boiling Point: 293.6°Cat760mmHg
- Flash Point: 124.3°C
- PSA: 35.25
- LogP: 3.86740
Benzenepropanamine, a-ethyl-4-methoxy-, hydrochloride(1:1) Related Literature
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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