Cas no 41847-61-4 (D-Tagatose)
D-Tagatose structure
Product Name:D-Tagatose
CAS No:41847-61-4
MF:C6H12O6
MW:180.155882835388
CID:4556266
Update Time:2023-08-10
D-Tagatose Chemical and Physical Properties
Names and Identifiers
-
- D-Lyxo-Hex-2-ulo-Pyranose
- D-Tag
- D-Tagatopyranose
- D-Tagatopyranoside
- D-Tagatose
- Tag
- Tagatopyranose
- Tagatopyranoside
- Tagatose
- lyxo-Hexulose
- D-(?)-Tagatose
- bmse000023
- bmse000865
- bmse000883
- (3S,4S,5R)-2-(hydroxymethyl)oxane-2,3,4,5-tetrol
- C00795
- Q27106317
-
- Inchi： 1S/C6H12O6/c7-2-6(11)5(10)4(9)3(8)1-12-6/h3-5,7-11H,1-2H2/t3-,4+,5+,6?/m1/s1
- InChI Key： LKDRXBCSQODPBY-OEXCPVAWSA-N
- SMILES： O1C[C@H]([C@@H]([C@@H](C1(CO)O)O)O)O
Computed Properties
- Exact Mass: 180.06338810 g/mol
- Monoisotopic Mass: 180.06338810 g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 162
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Molecular Weight: 180.16
- XLogP3: -2.8
- Topological Polar Surface Area: 110
D-Tagatose Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：Store at recommended temperature
D-Tagatose Related Literature
-
Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
-
R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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