Cas no 25265-75-2 (Butanediol)
Butanediol structure
Product Name:Butanediol
CAS No:25265-75-2
MF:C4H10O2
MW:90.1210017204285
CID:282821
PubChem ID:165788
Update Time:2025-04-19
Butanediol Chemical and Physical Properties
Names and Identifiers
-
- Butanediol
- Butyleneglycol
- CDQSJQSWAWPGKG-UHFFFAOYSA-N
- 25265-75-2
- starbld0029295
- NS00113659
- UNII-TMS4MGA0H4
- DTXSID7074745
- butane diol
- 99801-86-2
- butane-1,1-diol
- TMS4MGA0H4
- Butylene glycol
-
- Inchi： 1S/C4H10O2/c1-2-3-4(5)6/h4-6H,2-3H2,1H3
- InChI Key： CDQSJQSWAWPGKG-UHFFFAOYSA-N
- SMILES： OC(CCC)O
Computed Properties
- Exact Mass: 90.0681
- Monoisotopic Mass: 90.068079557g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 6
- Rotatable Bond Count: 2
- Complexity: 26.7
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.4
- Topological Polar Surface Area: 40.5?2
Experimental Properties
- Density: 1.021 g/cm3 (20 oC),
- Melting Point: 199 oC
- Refractive Index: 1.4460 (589.3 nm 20 oC)
- PSA: 40.46
Butanediol Related Literature
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
-
Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
25265-75-2 (Butanediol) Related Products
- 26762-52-7(Hexanediol)
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 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)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
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