Home Other Building Blocks (2-phenyloxan-3-yl)methanamine, Mixture of diastereomers

(2-phenyloxan-3-yl)methanamine, Mixture of diastereomers

CAS No.:
1210929-18-2
Catalog Number:
AG019W2Y
Molecular Formula:
C12H17NO
Molecular Weight:
191.2695
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Product Description
Catalog Number:
AG019W2Y
Chemical Name:
(2-phenyloxan-3-yl)methanamine, Mixture of diastereomers
CAS Number:
1210929-18-2
Molecular Formula:
C12H17NO
Molecular Weight:
191.2695
MDL Number:
MFCD13195825
IUPAC Name:
(2-phenyloxan-3-yl)methanamine
InChI:
InChI=1S/C12H17NO/c13-9-11-7-4-8-14-12(11)10-5-2-1-3-6-10/h1-3,5-6,11-12H,4,7-9,13H2
InChI Key:
PFCSXYMDUSDGAZ-UHFFFAOYSA-N
SMILES:
NCC1CCCOC1c1ccccc1
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.131g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.274g/mol
Monoisotopic Mass:
191.131g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties