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141242-10-6 | Azulene, ethenyldimethyl- (9CI)
CAS No: 141242-10-6 Catalog No: AG001G4T MDL No:
Product Description
Catalog Number:
AG001G4T
Chemical Name:
Azulene, ethenyldimethyl- (9CI)
CAS Number:
141242-10-6
Molecular Formula:
C14H14
Molecular Weight:
182.2610
IUPAC Name:
1-ethenyl-2,3-dimethylazulene
InChI:
InChI=1S/C14H14/c1-4-12-10(2)11(3)13-8-6-5-7-9-14(12)13/h4-9H,1H2,2-3H3
InChI Key:
SNZUJWIMSLYNFT-UHFFFAOYSA-N
SMILES:
C=Cc1c(C)c(c2c1ccccc2)C
Properties
Complexity:
206
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:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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