phenanthren-9-ylthiourea

phenanthren-9-ylthiourea

CAS: 409317-74-4

Formula: C15H12N2S

SMILES: NC(=S)NC1=CC2=C(C=CC=C2)C2=C1C=CC=C2

IUPAC: (phenanthren-9-yl)thiourea

InChI: InChI=1S/C15H12N2S/c16-15(18)17-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9H,(H3,16,17,18)

Composition: C (71.40%), H (4.79%), N (11.10%), S (12.71%)

Molar Mass: 252.34

Atom Count: 30

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	252.072119568
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	2
InChIKey	XLVBYILFFQBEOQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.49
Topological Polar Surface Area	38.05
Polarizability	33.17
Ring Count	3
Rotatable Bond Count	1

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90%	<2 Days	409317-74-4		$51.35-$86.31$51.35$63.37$86.31