Home Other Building Blocks [4-methyl-2-(oxolan-3-ylmethoxy)phenyl]methanamine

[4-methyl-2-(oxolan-3-ylmethoxy)phenyl]methanamine

CAS No.:
1250057-67-0
Catalog Number:
AG019Z59
Molecular Formula:
C13H19NO2
Molecular Weight:
221.2955
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Product Description
Catalog Number:
AG019Z59
Chemical Name:
[4-methyl-2-(oxolan-3-ylmethoxy)phenyl]methanamine
CAS Number:
1250057-67-0
Molecular Formula:
C13H19NO2
Molecular Weight:
221.2955
MDL Number:
MFCD16731751
IUPAC Name:
[4-methyl-2-(oxolan-3-ylmethoxy)phenyl]methanamine
InChI:
InChI=1S/C13H19NO2/c1-10-2-3-12(7-14)13(6-10)16-9-11-4-5-15-8-11/h2-3,6,11H,4-5,7-9,14H2,1H3
InChI Key:
JBPMLIRZXQJDRX-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1OCC1COCC1)C
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.142g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.3g/mol
Monoisotopic Mass:
221.142g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties