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65813-53-8 | 2-Phenylpropyl isobutyrate
CAS No: 65813-53-8 Catalog No: AG003HVT MDL No:
Product Description
Catalog Number:
AG003HVT
Chemical Name:
2-Phenylpropyl isobutyrate
CAS Number:
65813-53-8
IUPAC Name:
2-phenylpropyl 2-methylpropanoate
InChI:
InChI=1S/C13H18O2/c1-10(2)13(14)15-9-11(3)12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3
InChI Key:
LZTCJUAHYXNKRE-UHFFFAOYSA-N
EC Number:
265-931-9
FEMA Number:
2892
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.285g/mol
Monoisotopic Mass:
206.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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