Cas no 150575-82-9 (Benzenemethanamine,4-(1,1-dimethylethoxy)-a-methyl-, (S)- (9CI))
150575-82-9 structure
Product Name:Benzenemethanamine,4-(1,1-dimethylethoxy)-a-methyl-, (S)- (9CI)
CAS No:150575-82-9
MF:C12H19NO
MW:193.285363435745
CID:135761
PubChem ID:29003338
Update Time:2025-04-19
Benzenemethanamine,4-(1,1-dimethylethoxy)-a-methyl-, (S)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanamine,4-(1,1-dimethylethoxy)-a-methyl-, (S)- (9CI)
- Benzenemethanamine, 4-(1,1-dimethylethoxy)-a-methyl-, (S)-
- BENZENEMETHANAMINE, 4-(1,1-DIMETHYLETHOXY)-Α-METHYL-, (S)- (9CI)
- 1(S)-(4-tert-butoxyphenyl)-1-ethylamine
- (1S)-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]ethanamine
- Benzenemethanamine, 4-(1,1-dimethylethoxy)-.alpha.-methyl-, (S)- (9CI)
- Benzenemethanamine, 4-(1,1-dimethylethoxy)--methyl-, (S)- (9CI)
- 150575-82-9
- AKOS012675215
- SCHEMBL2034762
-
- Inchi： 1S/C12H19NO/c1-9(13)10-5-7-11(8-6-10)14-12(2,3)4/h5-9H,13H2,1-4H3/t9-/m0/s1
- InChI Key： UHABPKRKFRDALK-VIFPVBQESA-N
- SMILES： O(C1C=CC(=CC=1)[C@H](C)N)C(C)(C)C
Computed Properties
- Exact Mass: 193.14700
- Monoisotopic Mass: 193.146664230g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 166
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.1
- Topological Polar Surface Area: 35.2?2
Experimental Properties
- PSA: 35.25000
- LogP: 3.58390
Benzenemethanamine,4-(1,1-dimethylethoxy)-a-methyl-, (S)- (9CI) Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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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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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
150575-82-9 (Benzenemethanamine,4-(1,1-dimethylethoxy)-a-methyl-, (S)- (9CI)) Related Products
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
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- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
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