Home Other Building Blocks [1-(2-phenylethyl)-1H-pyrrol-3-yl]methanol

[1-(2-phenylethyl)-1H-pyrrol-3-yl]methanol

CAS No.:
1514383-40-4
Catalog Number:
AG01C3BD
Molecular Formula:
C13H15NO
Molecular Weight:
201.2643
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Product Description
Catalog Number:
AG01C3BD
Chemical Name:
[1-(2-phenylethyl)-1H-pyrrol-3-yl]methanol
CAS Number:
1514383-40-4
Molecular Formula:
C13H15NO
Molecular Weight:
201.2643
MDL Number:
MFCD21768571
IUPAC Name:
[1-(2-phenylethyl)pyrrol-3-yl]methanol
InChI:
InChI=1S/C13H15NO/c15-11-13-7-9-14(10-13)8-6-12-4-2-1-3-5-12/h1-5,7,9-10,15H,6,8,11H2
InChI Key:
JUXHBFSZLPJYJB-UHFFFAOYSA-N
SMILES:
OCc1ccn(c1)CCc1ccccc1
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.115g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
201.269g/mol
Monoisotopic Mass:
201.115g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
25.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties