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2050-24-0 | Benzene, 1,3-diethyl-5-methyl-
CAS No: 2050-24-0 Catalog No: AG0029RW MDL No:
Product Description
Catalog Number:
AG0029RW
Chemical Name:
Benzene, 1,3-diethyl-5-methyl-
CAS Number:
2050-24-0
Molecular Formula:
C11H16
Molecular Weight:
148.2447
IUPAC Name:
1,3-diethyl-5-methylbenzene
InChI:
InChI=1S/C11H16/c1-4-10-6-9(3)7-11(5-2)8-10/h6-8H,4-5H2,1-3H3
InChI Key:
HILAULICMJUOLK-UHFFFAOYSA-N
SMILES:
CCc1cc(CC)cc(c1)C
EC Number:
218-086-5
UNII:
FKS4AY3P83
NSC Number:
62141
Properties
Complexity:
94.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.125g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.249g/mol
Monoisotopic Mass:
148.125g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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