Cas no 135913-02-9 (6-Bromo-4,4-Dimethylthiochroman)
135913-02-9 structure
Product Name:6-Bromo-4,4-Dimethylthiochroman
CAS No:135913-02-9
MF:C7H16N2O2
MW:160.214141845703
CID:135625
PubChem ID:2832231
Update Time:2025-04-19
6-Bromo-4,4-Dimethylthiochroman Chemical and Physical Properties
Names and Identifiers
-
- 6-Bromo-4,4-Dimethylthiochroman
- 1-AMINO-3-MORPHOLIN-4-YLPROPAN-2-OL
- FT-0755631
- 1-azanyl-3-morpholin-4-yl-propan-2-ol
- EN300-12626
- F3276-0010
- AMY2365
- 2-Hydroxy-3-morpholinylpropylamine
- BS-13384
- AKOS000118501
- CTA10538
- AC-7574
- 1-Amino-3-morpholin-4-yl-propan-2-ol
- 1-amino-3-(morpholine-4-yl)propane-2-ol
- Oprea1_741915
- AKOS016046630
- SCHEMBL457031
- 1-amino-3-(morpholin-4-yl)propan-2-ol
- 135913-02-9
- D72465
- SB46949
- 1-amino-3-morpholin-4-yl-propan-2-ol, AldrichCPR
- ALPHA-(AMINOMETHYL)-4-MORPHOLINEETHANOL
- 39849-45-1
- A6650
- MFCD00462792
- FT-0686262
- A824766
- CS-0008405
- Cambridge id 5182162
- SB47062
- 1-Amino-3-morpholino-2-propanol
- DTXSID40960417
- 1-amino-3-morpholinopropan-2-ol
- FT-0703529
- YSGPOQDTHDLUGE-UHFFFAOYSA-N
- 1-amino-3-(4-morpholinyl)-2-propanol
-
- Inchi： 1S/C7H16N2O2/c8-5-7(10)6-9-1-3-11-4-2-9/h7,10H,1-6,8H2
- InChI Key： YSGPOQDTHDLUGE-UHFFFAOYSA-N
- SMILES： O1CCN(CC1)CC(CN)O
Computed Properties
- Exact Mass: 303.95919
- Monoisotopic Mass: 160.121177757g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 105
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.7
- Topological Polar Surface Area: 58.7?2
Experimental Properties
- PSA: 9.23
6-Bromo-4,4-Dimethylthiochroman Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
-
Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
-
Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
135913-02-9 (6-Bromo-4,4-Dimethylthiochroman) Related Products
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