Home Other Building Blocks 3,5-dimethoxy-4-(propan-2-yl)aniline hydrochloride

3,5-dimethoxy-4-(propan-2-yl)aniline hydrochloride

CAS No.:
1432680-55-1
Catalog Number:
AG01A565
Molecular Formula:
C11H18ClNO2
Molecular Weight:
231.7191
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Product Description
Catalog Number:
AG01A565
Chemical Name:
3,5-dimethoxy-4-(propan-2-yl)aniline hydrochloride
CAS Number:
1432680-55-1
Molecular Formula:
C11H18ClNO2
Molecular Weight:
231.7191
MDL Number:
MFCD24369243
IUPAC Name:
3,5-dimethoxy-4-propan-2-ylaniline;hydrochloride
InChI:
InChI=1S/C11H17NO2.ClH/c1-7(2)11-9(13-3)5-8(12)6-10(11)14-4;/h5-7H,12H2,1-4H3;1H
InChI Key:
VGNHQEHUUJGTMP-UHFFFAOYSA-N
SMILES:
COc1cc(N)cc(c1C(C)C)OC.Cl
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.103g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
231.72g/mol
Monoisotopic Mass:
231.103g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties