cyclohexylmethylthiourea

cyclohexylmethylthiourea

CAS: 66892-28-2

Formula: C8H16N2S

SMILES: NC(=S)NCC1CCCCC1

IUPAC: (cyclohexylmethyl)thiourea

InChI: InChI=1S/C8H16N2S/c9-8(11)10-6-7-4-2-1-3-5-7/h7H,1-6H2,(H3,9,10,11)

Composition: C (55.77%), H (9.36%), N (16.26%), S (18.61%)

Molar Mass: 172.29

Atom Count: 27

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	172.103419697
Formal Charge	0
FSP3	0.87
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	2
InChIKey	GZZUQNWMRFWSAD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.78
Topological Polar Surface Area	38.05
Polarizability	20.46
Ring Count	1
Rotatable Bond Count	2

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98%	<2 Days	66892-28-2		$631.35-$4,597.70$631.35$1,147.70$4,597.70