Cas no 6493-92-1 ((S)-2-Methylbutyl acetate)
(S)-2-Methylbutyl acetate structure
Product Name:(S)-2-Methylbutyl acetate
CAS No:6493-92-1
MF:C7H14O2
MW:130.184862613678
CID:46819
PubChem ID:14139271
Update Time:2025-04-18
(S)-2-Methylbutyl acetate Chemical and Physical Properties
Names and Identifiers
-
- (S)-2-Methylbutyl acetate
- (2S)-2-Methyl-1-butanol acetate
- (+)-2-Methylbutylacetat
- (+)-Essigsaeure-< 2-methylbutyl> -ester
- (S)-1-acetoxy-2-methyl-butane
- 1-Butanol, 2-methyl-, acetate, (S)-
- 1-Butanol, 2-methyl-,acetate, (2S)-
- 1-Butanol,2-methyl-, acetate, (+)- (8CI)
- AG-G-43930
- CTK5C1894
- SCHEMBL12239784
- [(2S)-2-methylbutyl] acetate
- DTXSID40556410
- (2S)-2-Methylbutyl acetate
- 6493-92-1
-
- Inchi： 1S/C7H14O2/c1-4-6(2)5-9-7(3)8/h6H,4-5H2,1-3H3/t6-/m0/s1
- InChI Key： XHIUFYZDQBSEMF-LURJTMIESA-N
- SMILES： O(C(C)=O)C[C@@H](C)CC
Computed Properties
- Exact Mass: 130.09942
- Monoisotopic Mass: 130.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 88.9
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.1
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 0.879
- Boiling Point: 135 oC
- Flash Point: 35 oC
- Refractive Index: 1.404
- PSA: 26.3
- LogP: 1.59560
- FEMA: 3644
(S)-2-Methylbutyl acetate Related Literature
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
6493-92-1 ((S)-2-Methylbutyl acetate) Related Products
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