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52244-70-9 | 4-(4-Methoxyphenyl)-1-Butanol
CAS No: 52244-70-9 Catalog No: AG003K47 MDL No:MFCD00002972
Product Description
Catalog Number:
AG003K47
Chemical Name:
4-(4-Methoxyphenyl)-1-Butanol
CAS Number:
52244-70-9
Molecular Formula:
C11H16O2
Molecular Weight:
180.2435
MDL Number:
MFCD00002972
IUPAC Name:
4-(4-methoxyphenyl)butan-1-ol
InChI:
InChI=1S/C11H16O2/c1-13-11-7-5-10(6-8-11)4-2-3-9-12/h5-8,12H,2-4,9H2,1H3
InChI Key:
ONIBHZIXCLTLNO-UHFFFAOYSA-N
SMILES:
OCCCCc1ccc(cc1)OC
EC Number:
257-782-3
NSC Number:
141198
Properties
Complexity:
117
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.247g/mol
Monoisotopic Mass:
180.115g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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