CAS 103-09-3 | 2-Ethylhexyl acetate | CAS Number 103-09-3

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103-09-3 | 2-Ethylhexyl acetate

CAS No: 103-09-3 Catalog No: AG003H7S MDL No:MFCD00027249

Product Description

Catalog Number:

AG003H7S

Chemical Name:

2-Ethylhexyl acetate

CAS Number:

103-09-3

Molecular Formula:

C10H20O2

Molecular Weight:

172.2646

MDL Number:

MFCD00027249

IUPAC Name:

2-ethylhexyl acetate

InChI:

InChI=1S/C10H20O2/c1-4-6-7-10(5-2)8-12-9(3)11/h10H,4-8H2,1-3H3

InChI Key:

WOYWLLHHWAMFCB-UHFFFAOYSA-N

SMILES:

CCCCC(COC(=O)C)CC

NSC Number:

8897

Properties

Complexity:

121

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

172.146g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

172.268g/mol

Monoisotopic Mass:

172.146g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2

Literature

Title	Journal
Herbivory by a Phloem-feeding insect inhibits floral volatile production.	PloS one 20120101
Efficient hydrolytic reaction of an acetate ester with fungal lipase in a liquid-liquid interface bioreactor (L-L IBR) using CaCO₃-coated ballooned microsphere.	Journal of bioscience and bioengineering 20110801