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141-70-8 | Heptane, 2,2,6,6-tetramethyl-4-methylene-
CAS No: 141-70-8 Catalog No: AG001FQG MDL No:MFCD00026329
Product Description
Catalog Number:
AG001FQG
Chemical Name:
Heptane, 2,2,6,6-tetramethyl-4-methylene-
CAS Number:
141-70-8
Molecular Formula:
C12H24
Molecular Weight:
168.3190
MDL Number:
MFCD00026329
IUPAC Name:
2,2,6,6-tetramethyl-4-methylideneheptane
InChI:
InChI=1S/C12H24/c1-10(8-11(2,3)4)9-12(5,6)7/h1,8-9H2,2-7H3
InChI Key:
TUFZRYOCZCLYJO-UHFFFAOYSA-N
SMILES:
C=C(CC(C)(C)C)CC(C)(C)C
EC Number:
205-495-9
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.188g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.324g/mol
Monoisotopic Mass:
168.188g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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