Chemical Properties of Urea, 1-(2-chloroethyl)-1-nitro-3-(3,5,7-trimethyl-1-adamantyl)- (CAS 33021-99-7)

Urea, 1-(2-chloroethyl)-1-nitro-3-(3,5,7-trimethyl-1-adamantyl)-

InChI
InChI=1S/C16H26ClN3O2/c1-13-6-14(2)8-15(3,7-13)11-16(9-13,10-14)18-12(21)20(19-22)5-4-17/h4-11H2,1-3H3,(H,18,21)
InChI Key
RVKXSUCLMXKRLW-UHFFFAOYSA-N
Formula
C16H26ClN3O2
SMILES
CC12CC3(C)CC(C)(C1)CC(N=C(O)N(CCCl)N=O)(C2)C3
Molecular Weight1
327.85
CAS
33021-99-7
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Physical Properties

Property Value Unit Source
ω 0.8951 Relay (1.0) Calculated Property
ΔfG° 162.19 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -390.17 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 108.08 kJ/mol Relay (1.0) Calculated Property
IE 8.98 eV Relay (1.0) Calculated Property
log10WS -4.96 Relay (1.0) Calculated Property
logPoct/wat 4.262 Crippen Calculated Property
McVol 249.040 ml/mol McGowan Calculated Property
Pc 1963.07 kPa Joback Calculated Property
Tboil 620.48 K Relay (1.0) Calculated Property
Tc 921.85 K Relay (1.0) Calculated Property
Tfus 408.56 K Relay (1.0) Calculated Property
Vc 0.923 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Semustine. Glycine-threonine-phenylalanine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. 1-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl-ethoxyphosphoryl]pyrrolidin-2-one. 4H,6h-m-dioxino[4',5':5,6]pyrano[4,3-d]-4-oxazolin-2-one, hexahydro-4-methoxy-1,8-diphenyl-. 2'-Deoxyinosine, tris(tert-butyldimethylsilyl) derivative. Ipanguline D9. Isoipanguline D9. Isoflupredone, tetra-TMS. hydrocinchonine. 2'-Deoxyinosine, tris(trimethylsilyl) derivative. adenosine-2'-monophosphate, TMS. Adenosine, 2'-deoxy-N-(trimethylsilyl)-3'-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. Cytosine arabinoside, buto-oxime-TMS derivative. N6-TMS-2'-Deoxyadenosine, 3',5'-bis-O-TBDMS. 2'-Deoxyadenosine, 3',5',N6-tris(O-TBDMSi).

Find more compounds similar to Urea, 1-(2-chloroethyl)-1-nitro-3-(3,5,7-trimethyl-1-adamantyl)-.

Sources

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