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119437-35-3 | Benzene, 1-(3-chloropropyl)-4-phenoxy-
CAS No: 119437-35-3 Catalog No: AG000P7D MDL No:
Product Description
Catalog Number:
AG000P7D
Chemical Name:
Benzene, 1-(3-chloropropyl)-4-phenoxy-
CAS Number:
119437-35-3
Molecular Formula:
C15H15ClO
Molecular Weight:
246.7320
IUPAC Name:
1-(3-chloropropyl)-4-phenoxybenzene
InChI:
InChI=1S/C15H15ClO/c16-12-4-5-13-8-10-15(11-9-13)17-14-6-2-1-3-7-14/h1-3,6-11H,4-5,12H2
InChI Key:
LEJWPINMKWENAT-UHFFFAOYSA-N
SMILES:
ClCCCc1ccc(cc1)Oc1ccccc1
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.081g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.734g/mol
Monoisotopic Mass:
246.081g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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