1-Boc-3-Hydroxy-4-phenylpiperidine

CAT: 0926-AQB93104-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0926-AQB93104-01Size:1 g

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CAS Number

1000931-04-3

MDL Number

MFCD08461249

Smiles

CC (C) (C) OC (=O) N1CCC (C (C1) O) C2=CC=CC=C2

Molecular Formula

C16H23NO3

Molecular Weight

277.36 g/mol

Controlled

Chemical Information

Tert-butyl 3-hydroxy-4-phenylpiperidine-1-carboxylate

CAS Number	1000931-04-3
PubChem CID	20664715
IUPAC Name	tert-butyl 3-hydroxy-4-phenylpiperidine-1-carboxylate
Molecular Formula	C16H23NO3
Molecular Weight	277.36
XLogP	2.4
Topological Polar Surface Area	49.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	20
Formal Charge	0
Complexity	331

SMILES

CC(C)(C)OC(=O)N1CCC(C(C1)O)C2=CC=CC=C2

InChI

InChI=1S/C16H23NO3/c1-16(2,3)20-15(19)17-10-9-13(14(18)11-17)12-7-5-4-6-8-12/h4-8,13-14,18H,9-11H2,1-3H3

InChIKey

HWNKSGVMOCONJS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1000931-04-3

CID: 20664715

Formula: C16H23NO3

MW: 277.36

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	277.36
XLogP3	2.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	277.16779360
Monoisotopic Mass	277.16779360
Topological Polar Surface Area	49.8 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	331
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
IGA14482-01	1-Boc-4- (aminomethyl) -4-phenylpiperidine
LYB58186-01	1-Boc-4-amino-4-phenylpiperidine
FAA00494-01	4-Hydroxy-4-phenylpiperidine hydrochloride
VXC71864-01	Tert-Butyl 4-hydroxy-2-phenylpiperidine-1-carboxylate
KHD52320-01	N'-Hydroxy-6-oxo-1-phenylpiperidine-3-carboximidamide
HCA42007-01	3-Methyl-4-phenylpiperidine
FNB02890-01	Trans-1-Boc-4-hydroxy-3-methylpiperidine
ZPA79475	Trans-1-Boc-3-Hydroxy-4-methylpiperidine
EEC95174-01	3-Ethyl-4-phenylpiperidine
HAB35256	1-Boc-3-Phenylpiperidin-4-one

Catalog	Name
432672-01	4-Hydroxy-4-phenylpiperidine
161418	4-Hydroxy-4-Phenylpiperidine Hydrochloride
OR73046-01	Tert-Butyl 3-hydroxy-4-phenylpiperidine-1-carboxylate
OR322299-01	Boc-4-phenylpiperidine-4-carboxylic acid
OR1064847-01	Ethyl cis-N-Boc-3-phenylpiperidine-4-carboxylate
408908-01	1-Boc-3-hydroxy-4-methylenepiperidine
266627-01	Boc-cis-DL-4-phenylpiperidine-3-carboxylic acid
OR77626-01	Tert-Butyl 3-hydroxy-3-phenylpiperidine-1-carboxylate
sc-261700	4-Boc-aminomethyl-3-hydroxy-1-N-Boc-pyrrolidine
sc-358098A	Cis-4-Phenylpiperidine-3-carboxylic acid, N-BOC protected