Home Other Building Blocks 1-cyclobutoxy-4-ethynylbenzene

1-cyclobutoxy-4-ethynylbenzene

CAS No.:
1850942-27-6
Catalog Number:
AG01AUJ5
Molecular Formula:
C12H12O
Molecular Weight:
172.2231
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Product Description
Catalog Number:
AG01AUJ5
Chemical Name:
1-cyclobutoxy-4-ethynylbenzene
CAS Number:
1850942-27-6
Molecular Formula:
C12H12O
Molecular Weight:
172.2231
MDL Number:
MFCD23108236
IUPAC Name:
1-cyclobutyloxy-4-ethynylbenzene
InChI:
InChI=1S/C12H12O/c1-2-10-6-8-12(9-7-10)13-11-4-3-5-11/h1,6-9,11H,3-5H2
InChI Key:
VTGJCMVCKAUMPS-UHFFFAOYSA-N
SMILES:
C#Cc1ccc(cc1)OC1CCC1
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.089g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.227g/mol
Monoisotopic Mass:
172.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties