Home Carboxys tert-butyl 3-[(4-hydroxyphenyl)methyl]piperidine-1-carboxylate

tert-butyl 3-[(4-hydroxyphenyl)methyl]piperidine-1-carboxylate

CAS No.:
1780865-15-7
Catalog Number:
AG01EMOS
Molecular Formula:
C17H25NO3
Molecular Weight:
291.3853
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Product Description
Catalog Number:
AG01EMOS
Chemical Name:
tert-butyl 3-[(4-hydroxyphenyl)methyl]piperidine-1-carboxylate
CAS Number:
1780865-15-7
Molecular Formula:
C17H25NO3
Molecular Weight:
291.3853
MDL Number:
MFCD31615848
IUPAC Name:
tert-butyl 3-[(4-hydroxyphenyl)methyl]piperidine-1-carboxylate
InChI:
InChI=1S/C17H25NO3/c1-17(2,3)21-16(20)18-10-4-5-14(12-18)11-13-6-8-15(19)9-7-13/h6-9,14,19H,4-5,10-12H2,1-3H3
InChI Key:
ZIZVLALTVQIBTM-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)CC1CCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
342  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.183g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
291.391g/mol
Monoisotopic Mass:
291.183g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties