Home Other Building Blocks Amyl Acetate

Amyl Acetate

CAS No.:
628-63-7
Catalog Number:
AG0034GX
Molecular Formula:
C7H14O2
Molecular Weight:
130.1849
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Product Description
Catalog Number:
AG0034GX
Chemical Name:
Amyl Acetate
CAS Number:
628-63-7
Molecular Formula:
C7H14O2
Molecular Weight:
130.1849
MDL Number:
MFCD00009500
IUPAC Name:
pentyl acetate
InChI:
InChI=1S/C7H14O2/c1-3-4-5-6-9-7(2)8/h3-6H2,1-2H3
InChI Key:
PGMYKACGEOXYJE-UHFFFAOYSA-N
SMILES:
CCCCCOC(=O)C
EC Number:
211-047-3
UNII:
92Q24NH7AS
NSC Number:
7923
RTECS Number:
AJ1925000
UN Number:
1104
Properties
Complexity:
79  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.099g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.187g/mol
Monoisotopic Mass:
130.099g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
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