Home Other Building Blocks Benzenepropanol,4-(1,1-dimethylethyl)-

Benzenepropanol,4-(1,1-dimethylethyl)-

CAS No.:
78574-08-0
Catalog Number:
AG0052QG
Molecular Formula:
C13H20O
Molecular Weight:
192.2973
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Product Description
Catalog Number:
AG0052QG
Chemical Name:
Benzenepropanol,4-(1,1-dimethylethyl)-
CAS Number:
78574-08-0
Molecular Formula:
C13H20O
Molecular Weight:
192.2973
MDL Number:
MFCD00464127
IUPAC Name:
3-(4-tert-butylphenyl)propan-1-ol
InChI:
InChI=1S/C13H20O/c1-13(2,3)12-8-6-11(7-9-12)5-4-10-14/h6-9,14H,4-5,10H2,1-3H3
InChI Key:
QFIGRGCEUZQJNG-UHFFFAOYSA-N
SMILES:
OCCCc1ccc(cc1)C(C)(C)C
EC Number:
616-636-2
Properties
Complexity:
149  
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties