Home Nitriles 4-(azetidin-3-yloxy)benzonitrile hydrochloride

4-(azetidin-3-yloxy)benzonitrile hydrochloride

CAS No.:
1236862-00-2
Catalog Number:
AG00HHDY
Molecular Formula:
C10H11ClN2O
Molecular Weight:
210.6601
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Product Description
Catalog Number:
AG00HHDY
Chemical Name:
4-(azetidin-3-yloxy)benzonitrile hydrochloride
CAS Number:
1236862-00-2
Molecular Formula:
C10H11ClN2O
Molecular Weight:
210.6601
MDL Number:
MFCD26407821
IUPAC Name:
4-(azetidin-3-yloxy)benzonitrile;hydrochloride
InChI:
InChI=1S/C10H10N2O.ClH/c11-5-8-1-3-9(4-2-8)13-10-6-12-7-10;/h1-4,10,12H,6-7H2;1H
InChI Key:
JMLTYJWMTBIZMK-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)OC1CNC1.Cl
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.056g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
210.661g/mol
Monoisotopic Mass:
210.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties