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tert-butyl N-[(1R,2S)-2-(4-hydroxyphenyl)cyclopropyl]carbamate

tert-butyl N-[(1R,2S)-2-(4-hydroxyphenyl)cyclopropyl]carbamate

CAS: 1196053-06-1

Formula: C14H19NO3

SMILES: CC(C)(C)OC(=O)N[C@@H]1C[C@H]1C1=CC=C(O)C=C1

IUPAC: tert-butyl N-[(1R,2S)-2-(4-hydroxyphenyl)cyclopropyl]carbamate

InChI: InChI=1S/C14H19NO3/c1-14(2,3)18-13(17)15-12-8-11(12)9-4-6-10(16)7-5-9/h4-7,11-12,16H,8H2,1-3H3,(H,15,17)/t11-,12+/m0/s1

Composition: C (67.45%), H (7.68%), N (5.62%), O (19.25%)

Molar Mass: 249.31

Atom Count: 37

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 249.136493476
Formal Charge 0
FSP3 0.5
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey UHGRVKQMNJTTRU-NWDGAFQWSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.55
Topological Polar Surface Area 58.56
Polarizability 26.84
Ring Count 2
Rotatable Bond Count 4

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