Home Other Building Blocks 3-Phenoxybenzylamine hydrochloride

3-Phenoxybenzylamine hydrochloride

CAS No.:
376637-85-3
Catalog Number:
AG00C86O
Molecular Formula:
C13H14ClNO
Molecular Weight:
235.7094
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Product Description
Catalog Number:
AG00C86O
Chemical Name:
3-Phenoxybenzylamine hydrochloride
CAS Number:
376637-85-3
Molecular Formula:
C13H14ClNO
Molecular Weight:
235.7094
MDL Number:
MFCD07781045
IUPAC Name:
(3-phenoxyphenyl)methanamine;hydrochloride
InChI:
InChI=1S/C13H13NO.ClH/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12;/h1-9H,10,14H2;1H
InChI Key:
WMFHUUKYIUOHRA-UHFFFAOYSA-N
SMILES:
NCc1cccc(c1)Oc1ccccc1.Cl
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.076g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
235.711g/mol
Monoisotopic Mass:
235.076g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties