Chemical Properties of Noruron (CAS 18530-56-8)

InChI

InChI=1S/C13H22N2O/c1-15(2)13(16)14-12-7-8-6-11(12)10-5-3-4-9(8)10/h8-12H,3-7H2,1-2H3,(H,14,16)/t8-,9-,10-,11+,12-/m1/s1

InChI Key

YGLMVCVJLXREAK-PZWNZHSQSA-N

Formula

SMILES

CN(C)C(=O)NC1CC2CC1C1CCCC21

Molecular Weight¹

221.32

CAS

18530-56-8

Other Names

(3a«alpha»,4«alpha»,5«alpha»,7«alpha»,7a«alpha»)-1,1-dimethyl-3-(octahydro-4,7-methano-1H-inden-5-yl)urea
(3aÂ«alphaÂ»,4Â«alphaÂ»,5Â«alphaÂ»,7Â«alphaÂ»,7aÂ«alphaÂ»)-1,1-dimethyl-3-(octahydro-4,7-methano-1H-inden-5-yl)urea
1-(3a,4,5,6,7,7a-Hexahydro-4,7-methano-5-indanyl)-3,3-dimethylurea
1-(5-(3a,4,5,6,7,7a-Hexahydro-4,7-methanoindanyl))-3,3-dimethylurea
1-(Tetrahydrodicyclopentadienyl)-3,3-dimethylurea
3-(5-(3a,4,5,6,7,7a-Hexahydro-4,6-methanoindanyl))-1,1-dimethylurea
3-(Hexahydro-4,7-methanoindan-5-yl)-1,1-dimethylurea
Asepta Herban
Herban
Hercules 7531
N,N-dimethyl-N'-(octahydro-4,7-methano-1H-inden-5-yl)urea
Narea
Norea
Nores
Urea, 3-(hexahydro-4,7-methanoindan-5-yl)-1,1-dimethyl-, endo,exo-5-
Urea, N,N-dimethyl-N'-(octahydro-4,7-methano-1H-inden-5-yl)-, (3a«alpha»,4«alpha»,5«alpha»,7«alpha»,7a«alpha»)-
Urea, N,N-dimethyl-N'-(octahydro-4,7-methano-1H-inden-5-yl)-, (3aÂ«alphaÂ»,4Â«alphaÂ»,5Â«alphaÂ»,7Â«alphaÂ»,7aÂ«alphaÂ»)-
Urea, N,N-dimethyl-N'-[(3aR,4S,5R,7S,7aR)-octahydro-4,7-methano-1H-inden-5-yl]-, rel-
isonoruron

C_p,gas : Ideal gas heat capacity (J/mol×K).
Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
log₁₀WS : Log10 of Water solubility in mol/l.
logP_oct/wat : Octanol/Water partition coefficient.
McVol : McGowan's characteristic volume (ml/mol).
P_c : Critical Pressure (kPa).
I_np : Non-polar retention indices.
T_boil : Normal Boiling Point Temperature (K).
T_c : Critical Temperature (K).
T_fus : Normal melting (fusion) point (K).
V_c : Critical Volume (m³/kmol).
¹: Molecular weight from the IUPAC atomic weights tables.

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Physical Properties

Property	Value	Unit	Source
Δ_fG°	284.56	kJ/mol	Joback Calculated Property
Δ_fH°_gas	-131.67	kJ/mol	Joback Calculated Property
Δ_fusH°	33.59	kJ/mol	Joback Calculated Property
Δ_vapH°	59.05	kJ/mol	Joback Calculated Property
log₁₀WS	[-3.17; -3.01]
log₁₀WS	-3.01		Aq. Sol...
log₁₀WS	-3.17		Estimat...
logP_oct/wat	2.082		Crippen Calculated Property
McVol	182.980	ml/mol	McGowan Calculated Property
P_c	2395.87	kPa	Joback Calculated Property
I_np	[1941.00; 1960.00]
I_np	1941.00		NIST
I_np	1960.00		NIST
I_np	1941.00		NIST
T_boil	628.47	K	Joback Calculated Property
T_c	838.21	K	Joback Calculated Property
T_fus	441.87 ± 0.20	K	NIST
V_c	0.683	m³/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
C_p,gas	[547.21; 650.26]	J/mol×K	[628.47; 838.21]

C_p,gas	547.21	J/mol×K	628.47	Joback Calculated Property
C_p,gas	567.38	J/mol×K	663.43	Joback Calculated Property
C_p,gas	586.22	J/mol×K	698.38	Joback Calculated Property
C_p,gas	603.82	J/mol×K	733.34	Joback Calculated Property
C_p,gas	620.30	J/mol×K	768.30	Joback Calculated Property
C_p,gas	635.74	J/mol×K	803.25	Joback Calculated Property
C_p,gas	650.26	J/mol×K	838.21	Joback Calculated Property
Δ_fusH	21.74	kJ/mol	436.50	NIST

Similar Compounds

Find more compounds similar to Noruron.

Sources

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