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114812-00-9 | Naphthalene, 1-(1-methyl-2-propen-1-yl)-
CAS No: 114812-00-9 Catalog No: AG000FAE MDL No:
Product Description
Catalog Number:
AG000FAE
Chemical Name:
Naphthalene, 1-(1-methyl-2-propen-1-yl)-
CAS Number:
114812-00-9
Molecular Formula:
C14H14
Molecular Weight:
182.2610
IUPAC Name:
1-but-3-en-2-ylnaphthalene
InChI:
InChI=1S/C14H14/c1-3-11(2)13-10-6-8-12-7-4-5-9-14(12)13/h3-11H,1H2,2H3
InChI Key:
FPPAXQRBHIIHGV-UHFFFAOYSA-N
SMILES:
C=CC(c1cccc2c1cccc2)C
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.11g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.266g/mol
Monoisotopic Mass:
182.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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