Home Aminos 3-(4-(Benzyloxy)-2-((dimethylamino)methyl)-1-hydroxycyclohexyl)phenol hydrochloride

3-(4-(Benzyloxy)-2-((dimethylamino)methyl)-1-hydroxycyclohexyl)phenol hydrochloride

CAS No.:
1841081-56-8
Catalog Number:
AG00I1GF
Molecular Formula:
C22H30ClNO3
Molecular Weight:
391.9315
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Product Description
Catalog Number:
AG00I1GF
Chemical Name:
3-(4-(Benzyloxy)-2-((dimethylamino)methyl)-1-hydroxycyclohexyl)phenol hydrochloride
CAS Number:
1841081-56-8
Molecular Formula:
C22H30ClNO3
Molecular Weight:
391.9315
MDL Number:
MFCD29056529
IUPAC Name:
3-[2-[(dimethylamino)methyl]-1-hydroxy-4-phenylmethoxycyclohexyl]phenol;hydrochloride
InChI:
InChI=1S/C22H29NO3.ClH/c1-23(2)15-19-14-21(26-16-17-7-4-3-5-8-17)11-12-22(19,25)18-9-6-10-20(24)13-18;/h3-10,13,19,21,24-25H,11-12,14-16H2,1-2H3;1H
InChI Key:
FYZAOONCMZPBAR-UHFFFAOYSA-N
SMILES:
CN(CC1CC(OCc2ccccc2)CCC1(O)c1cccc(c1)O)C.Cl
Properties
Complexity:
424  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
391.191g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
391.936g/mol
Monoisotopic Mass:
391.191g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
Properties