Cas no 132259-10-0 (Oxygen)
Oxygen structure
Product Name:Oxygen
CAS No:132259-10-0
MF:C37H51Cl2N3O5S
MW:720.788947343826
CID:93402
PubChem ID:195130
Update Time:2025-04-18
Oxygen Chemical and Physical Properties
Names and Identifiers
-
- Oxygen
- CAL-MAT AIR
- AIR
- Air, refrigerated liquid (cryogenic liquid).
- COMPRESSED AIR, BREATHING AIR
- Ambient air
- Southern oceanic air
- Hoe 166
- R-(+)-3,4-Dihydro-2-isopropyl-4-methyl-2-(2-(4-(4-(2(3,4,5-trimethoxyphenyl)ethyl)piperazinyl)butoxy)phenyl)-2H-1,4-benzothiazin-3-on-dihydrochloride
- 2H-1,4-Benzothiazin-3(4H)-one, 4-methyl-2-(1-methylethyl)-2-(2-(4-(4-(2-(3,4,5-trimethoxyphenyl)ethyl)-1-piperazinyl)butyl)phenyl)-, dihydrochloride, (R)-
- (2R)-4-methyl-2-propan-2-yl-2-[2-[4-[4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-1-yl]butoxy]phenyl]-1,4-benzothiazin-3-one;dihydrochloride
- 4-Methyl-2-(propan-2-yl)-2-[2-(4-{4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-1-yl}butoxy)phenyl]-2H-1,4-benzothiazin-3(4H)-one--hydrogen chloride (1/2)
- Hoe-166
- 115043-27-1
- DTXSID00921600
- 132259-10-0
- HQTMLRUQTHILKM-CHKASDEDSA-N
-
- Inchi： 1S/C37H49N3O5S.2ClH/c1-27(2)37(36(41)38(3)30-14-8-10-16-34(30)46-37)29-13-7-9-15-31(29)45-24-12-11-18-39-20-22-40(23-21-39)19-17-28-25-32(42-4)35(44-6)33(26-28)43-5;;/h7-10,13-16,25-27H,11-12,17-24H2,1-6H3;2*1H/t37-;;/m1../s1
- InChI Key： HQTMLRUQTHILKM-CHKASDEDSA-N
- SMILES： Cl.Cl.S1C2C=CC=CC=2N(C)C([C@]1(C1=CC=CC=C1OCCCCN1CCN(CCC2C=C(C(=C(C=2)OC)OC)OC)CC1)C(C)C)=O
Computed Properties
- Exact Mass: 719.2926483g/mol
- Monoisotopic Mass: 719.2926483g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 48
- Rotatable Bond Count: 14
- Complexity: 921
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 89?2
Experimental Properties
- Boiling Point: ?189?°C(lit.)
Oxygen Security Information
- Hazardous Material transportation number：UN 1002 2.2
- WGK Germany：3
- Safety Instruction： 36
Oxygen Related Literature
-
J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
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
-
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
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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