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tert-butyl N-[(2S)-1-(4-hydroxyphenyl)-3-oxopropan-2-yl]carbamate

tert-butyl N-[(2S)-1-(4-hydroxyphenyl)-3-oxopropan-2-yl]carbamate

CAS: 134081-15-5

Formula: C14H19NO4

SMILES: CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(O)C=C1)C=O

IUPAC: tert-butyl N-[(2S)-1-(4-hydroxyphenyl)-3-oxopropan-2-yl]carbamate

InChI: InChI=1S/C14H19NO4/c1-14(2,3)19-13(18)15-11(9-16)8-10-4-6-12(17)7-5-10/h4-7,9,11,17H,8H2,1-3H3,(H,15,18)/t11-/m0/s1

Composition: C (63.38%), H (7.22%), N (5.28%), O (24.12%)

Molar Mass: 265.309

Atom Count: 38

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 265.131408096
Formal Charge 0
FSP3 0.43
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey WKIZYNITOUKXRN-NSHDSACASA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.04
Topological Polar Surface Area 75.63
Polarizability 27.66
Ring Count 1
Rotatable Bond Count 6

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 134081-15-5 $1,474.00-$3,894.00$1,474.00$2,596.00$3,894.00
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