4-(2-nitrophenyl)thiomorpholine

4-(2-nitrophenyl)thiomorpholine

CAS: 428819-37-8

Formula: C10H12N2O2S

SMILES: [O-][N+](=O)C1=C(C=CC=C1)N1CCSCC1

IUPAC: 4-(2-nitrophenyl)thiomorpholine

InChI: InChI=1S/C10H12N2O2S/c13-12(14)10-4-2-1-3-9(10)11-5-7-15-8-6-11/h1-4H,5-8H2

Composition: C (53.55%), H (5.39%), N (12.49%), O (14.27%), S (14.29%)

Molar Mass: 224.28

Atom Count: 27

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	224.061948808
Formal Charge	0
FSP3	0.4
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	NEKPVRYSVKNVMG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.17
Topological Polar Surface Area	46.38
Polarizability	23.04
Ring Count	2
Rotatable Bond Count	2

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