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101266-90-4 | Benzene, (3-propoxy-1-buten-1-yl)-
CAS No: 101266-90-4 Catalog No: AG00043Z MDL No:
Product Description
Catalog Number:
AG00043Z
Chemical Name:
Benzene, (3-propoxy-1-buten-1-yl)-
CAS Number:
101266-90-4
Molecular Formula:
C13H18O
Molecular Weight:
190.2814
IUPAC Name:
3-propoxybut-1-enylbenzene
InChI:
InChI=1S/C13H18O/c1-3-11-14-12(2)9-10-13-7-5-4-6-8-13/h4-10,12H,3,11H2,1-2H3
InChI Key:
FOGJECAOUCGEDT-UHFFFAOYSA-N
SMILES:
CCCOC(C=Cc1ccccc1)C
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.286g/mol
Monoisotopic Mass:
190.136g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.5
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