Home Other Building Blocks 2-[(3-methoxyphenyl)methyl]piperazine

2-[(3-methoxyphenyl)methyl]piperazine

CAS No.:
218594-59-3
Catalog Number:
AG01BR36
Molecular Formula:
C12H18N2O
Molecular Weight:
206.2841
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Product Description
Catalog Number:
AG01BR36
Chemical Name:
2-[(3-methoxyphenyl)methyl]piperazine
CAS Number:
218594-59-3
Molecular Formula:
C12H18N2O
Molecular Weight:
206.2841
MDL Number:
MFCD07373252
IUPAC Name:
2-[(3-methoxyphenyl)methyl]piperazine
InChI:
InChI=1S/C12H18N2O/c1-15-12-4-2-3-10(8-12)7-11-9-13-5-6-14-11/h2-4,8,11,13-14H,5-7,9H2,1H3
InChI Key:
DRKUIOHLHFFGOP-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)CC1CNCCN1
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.142g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.289g/mol
Monoisotopic Mass:
206.142g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
33.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties