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3042-57-7 | Naphthalene, 2-(1-ethylpropyl)-
CAS No: 3042-57-7 Catalog No: AG00302V MDL No:
Product Description
Catalog Number:
AG00302V
Chemical Name:
Naphthalene, 2-(1-ethylpropyl)-
CAS Number:
3042-57-7
Molecular Formula:
C15H18
Molecular Weight:
198.3034
IUPAC Name:
2-pentan-3-ylnaphthalene
InChI:
InChI=1S/C15H18/c1-3-12(4-2)15-10-9-13-7-5-6-8-14(13)11-15/h5-12H,3-4H2,1-2H3
InChI Key:
WXKMPZORXBGZGK-UHFFFAOYSA-N
SMILES:
CCC(c1ccc2c(c1)cccc2)CC
NSC Number:
114549
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.141g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.309g/mol
Monoisotopic Mass:
198.141g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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