Home Other Building Blocks 2-(3-phenylprop-1-ynyl)furan

2-(3-phenylprop-1-ynyl)furan

CAS No.:
502-22-7
Catalog Number:
AG0037RL
Molecular Formula:
C13H10O
Molecular Weight:
182.2179
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Product Description
Catalog Number:
AG0037RL
Chemical Name:
2-(3-phenylprop-1-ynyl)furan
CAS Number:
502-22-7
Molecular Formula:
C13H10O
Molecular Weight:
182.2179
MDL Number:
MFCD30474864
IUPAC Name:
2-(3-phenylprop-1-ynyl)furan
InChI:
InChI=1S/C13H10O/c1-2-6-12(7-3-1)8-4-9-13-10-5-11-14-13/h1-3,5-7,10-11H,8H2
InChI Key:
ICRHFCVRNWSKQH-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CC#Cc1ccco1
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.073g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.222g/mol
Monoisotopic Mass:
182.073g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties