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6639-14-1

6639-14-1 | n-Propyl 2-methylvalerate, 98%

CAS No: 6639-14-1 Catalog No: AG003TBL MDL No:

Product Description

Catalog Number:
AG003TBL
Chemical Name:
n-Propyl 2-methylvalerate, 98%
CAS Number:
6639-14-1
IUPAC Name:
propyl 2-methylpentanoate
InChI:
InChI=1S/C9H18O2/c1-4-6-8(3)9(10)11-7-5-2/h8H,4-7H2,1-3H3
InChI Key:
AJYNZTLCODJWQR-UHFFFAOYSA-N
NSC Number:
17877

Properties

Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.131g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.241g/mol
Monoisotopic Mass:
158.131g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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