Cas no 7147-74-2 (D-Arabinitol,1-C-1H-benzimidazol-2-yl-, (1S)-)
7147-74-2 structure
Product Name:D-Arabinitol,1-C-1H-benzimidazol-2-yl-, (1S)-
CAS No:7147-74-2
MF:C12H16N2O5
MW:268.265843391418
CID:569283
PubChem ID:220419
Update Time:2025-04-19
D-Arabinitol,1-C-1H-benzimidazol-2-yl-, (1S)- Chemical and Physical Properties
Names and Identifiers
-
- D-Arabinitol,1-C-1H-benzimidazol-2-yl-, (1S)-
- 1-(1H-benzimidazol-2-yl)pentane-1,2,3,4,5-pentol
- 1-(1H-benzoimidazol-2-yl)pentane-1,2,3,4,5-pentol
- (1S)-1-(1H-Benzimidazol-2-yl)-D-arabit
- (1S)-1-(1H-benzimidazol-2-yl)-D-arabitol
- (1'S,2'R,3'R,4'R)-2-[1',2',3',4',5'-pentahydroxypentyl]-1H-benzimidazole
- 2-(D-gluco-1,2,3,4,5-pentahydroxypentyl)-1H-benzimidazole
- 2-(D-glucopentahydroxyamyl)benzimidazole
- 2-(D-gluco-pentitol-1-yl)benzimidazole
- 2-[(D-gluco-1,2,3,4,5-pentahydroxyl)pentyl]-1H-benzimidazole
- Nsc43663
- Oprea1_706259
- Oprea1_596588
- HMS2646J12
- NSC405920
- NSC3156
- 5338-40-9
- 1-C-(1H-benzimidazol-2-yl)pentitol
- NSC-3156
- AKOS000568899
- NoName_4326
- NSC-405921
- SCHEMBL12858717
- NSC-405920
- CHEMBL1519937
- NCIOpen2_002341
- 7510-96-5
- 7510-97-6
- NSC-56088
- AKOS016195779
- NSC-405922
- SR-01000317803
- HMS1755N16
- NSC56088
- NSC405921
- 1-C-1H-benzimidazol-2-ylpentitol
- SMR000285272
- NSC-43663
- Cambridge id 5219223
- DTXSID00903623
- 7770-62-9
- NSC405922
- 7147-74-2
- MLS000678318
- SR-01000317803-1
- NCIOpen2_002264
- ZINC03857067
- Z56762860
-
- Inchi： 1S/C12H16N2O5/c15-5-8(16)9(17)10(18)11(19)12-13-6-3-1-2-4-7(6)14-12/h1-4,8-11,15-19H,5H2,(H,13,14)
- InChI Key： LBMJXDRTHCOBGU-UHFFFAOYSA-N
- SMILES： OC(C(C1=NC2C=CC=CC=2N1)O)C(C(CO)O)O
Computed Properties
- Exact Mass: 268.106
- Monoisotopic Mass: 268.106
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 6
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 19
- Rotatable Bond Count: 5
- Complexity: 293
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.9
- Topological Polar Surface Area: 130?2
Experimental Properties
- PSA: 129.83000
- LogP: -1.32870
D-Arabinitol,1-C-1H-benzimidazol-2-yl-, (1S)- Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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