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588-67-0 | BENZYL BUTYL ETHER
CAS No: 588-67-0 Catalog No: AG003O3Z MDL No:MFCD00039954
Product Description
Catalog Number:
AG003O3Z
Chemical Name:
BENZYL BUTYL ETHER
CAS Number:
588-67-0
MDL Number:
MFCD00039954
IUPAC Name:
butoxymethylbenzene
InChI:
InChI=1S/C11H16O/c1-2-3-9-12-10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3
InChI Key:
MAYUYFCAPVDYBQ-UHFFFAOYSA-N
EC Number:
209-626-0
UNII:
8483X8ZO8N
NSC Number:
8476
FEMA Number:
2139
Properties
Complexity:
95.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.12g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.248g/mol
Monoisotopic Mass:
164.12g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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