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1007-70-1 | Benzene, (1-methoxycyclobutyl)-
CAS No: 1007-70-1 Catalog No: AG0002OC MDL No:
Product Description
Catalog Number:
AG0002OC
Chemical Name:
Benzene, (1-methoxycyclobutyl)-
CAS Number:
1007-70-1
Molecular Formula:
C11H14O
Molecular Weight:
162.2283
IUPAC Name:
(1-methoxycyclobutyl)benzene
InChI:
InChI=1S/C11H14O/c1-12-11(8-5-9-11)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3
InChI Key:
JMQDLZXLADGSHU-UHFFFAOYSA-N
SMILES:
COC1(CCC1)c1ccccc1
NSC Number:
98352
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.104g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.232g/mol
Monoisotopic Mass:
162.104g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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