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74926-93-5 | Phenol,2-(1-methylpropyl)-6-propyl-
CAS No: 74926-93-5 Catalog No: AG005G8E MDL No:
Product Description
Catalog Number:
AG005G8E
Chemical Name:
Phenol,2-(1-methylpropyl)-6-propyl-
CAS Number:
74926-93-5
Molecular Formula:
C13H20O
Molecular Weight:
192.2973
IUPAC Name:
2-butan-2-yl-6-propylphenol
InChI:
InChI=1S/C13H20O/c1-4-7-11-8-6-9-12(13(11)14)10(3)5-2/h6,8-10,14H,4-5,7H2,1-3H3
InChI Key:
DASIOEIBURQFMM-UHFFFAOYSA-N
SMILES:
CCCc1cccc(c1O)C(CC)C
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.151g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.302g/mol
Monoisotopic Mass:
192.151g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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