Home Other Building Blocks 3-Azetidinemethanamine, 1-(phenylmethyl)-

3-Azetidinemethanamine, 1-(phenylmethyl)-

CAS No.:
1219967-55-1
Catalog Number:
AG0016IG
Molecular Formula:
C11H16N2
Molecular Weight:
176.2581
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Product Description
Catalog Number:
AG0016IG
Chemical Name:
3-Azetidinemethanamine, 1-(phenylmethyl)-
CAS Number:
1219967-55-1
Molecular Formula:
C11H16N2
Molecular Weight:
176.2581
MDL Number:
MFCD13562971
IUPAC Name:
(1-benzylazetidin-3-yl)methanamine
InChI:
InChI=1S/C11H16N2/c12-6-11-8-13(9-11)7-10-4-2-1-3-5-10/h1-5,11H,6-9,12H2
InChI Key:
UMJRHEQDUBTCKT-UHFFFAOYSA-N
SMILES:
NCC1CN(C1)Cc1ccccc1
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.131g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.263g/mol
Monoisotopic Mass:
176.131g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties