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4541-15-5 | 5-(Benzyloxy);pentan-1-ol
CAS No: 4541-15-5 Catalog No: AG003MF4 MDL No:MFCD00216583
Product Description
Catalog Number:
AG003MF4
Chemical Name:
5-(Benzyloxy);pentan-1-ol
CAS Number:
4541-15-5
Molecular Formula:
C12H18O2
Molecular Weight:
194.2701
MDL Number:
MFCD00216583
IUPAC Name:
5-phenylmethoxypentan-1-ol
InChI:
InChI=1S/C12H18O2/c13-9-5-2-6-10-14-11-12-7-3-1-4-8-12/h1,3-4,7-8,13H,2,5-6,9-11H2
InChI Key:
RZVDPWSEPVHOPU-UHFFFAOYSA-N
SMILES:
OCCCCCOCc1ccccc1
NSC Number:
5422
Properties
Complexity:
120
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:
1
Isotope Atom Count:
0
Molecular Weight:
194.274g/mol
Monoisotopic Mass:
194.131g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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