tert-butyl 4-(4-formyl-3-hydroxyphenyl)piperazine-1-carboxylate

tert-butyl 4-(4-formyl-3-hydroxyphenyl)piperazine-1-carboxylate

CAS: 1446332-69-9

Formula: C16H22N2O4

SMILES: CC(C)(C)OC(=O)N1CCN(CC1)C1=CC=C(C=O)C(O)=C1

IUPAC: tert-butyl 4-(4-formyl-3-hydroxyphenyl)piperazine-1-carboxylate

InChI: InChI=1S/C16H22N2O4/c1-16(2,3)22-15(21)18-8-6-17(7-9-18)13-5-4-12(11-19)14(20)10-13/h4-5,10-11,20H,6-9H2,1-3H3

Composition: C (62.73%), H (7.24%), N (9.14%), O (20.89%)

Molar Mass: 306.362

Atom Count: 44

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	306.157957196
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	ZCZVQJLBRKFTDC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	84.8
Topological Polar Surface Area	70.08
Polarizability	31.75
Ring Count	2
Rotatable Bond Count	4

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