Home Other Building Blocks 1-[4-(2-METHYLPROPYL)PHENYL]ETHANE-1,2-DIOL

1-[4-(2-METHYLPROPYL)PHENYL]ETHANE-1,2-DIOL

CAS No.:
1263162-32-8
Catalog Number:
AG01EICF
Molecular Formula:
C12H18O2
Molecular Weight:
194.2701
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Product Description
Catalog Number:
AG01EICF
Chemical Name:
1-[4-(2-METHYLPROPYL)PHENYL]ETHANE-1,2-DIOL
CAS Number:
1263162-32-8
Molecular Formula:
C12H18O2
Molecular Weight:
194.2701
MDL Number:
MFCD21881955
IUPAC Name:
1-[4-(2-methylpropyl)phenyl]ethane-1,2-diol
InChI:
InChI=1S/C12H18O2/c1-9(2)7-10-3-5-11(6-4-10)12(14)8-13/h3-6,9,12-14H,7-8H2,1-2H3
InChI Key:
SSTUHTOROWEIFL-UHFFFAOYSA-N
SMILES:
OCC(c1ccc(cc1)CC(C)C)O
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.131g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.274g/mol
Monoisotopic Mass:
194.131g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties