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6104-30-9

Basic Information
CAS No.: 6104-30-9
Name: Urea,N,N''-(2-methylpropylidene)bis-
Molecular Structure:
Molecular Structure of 6104-30-9 (Urea,N,N''-(2-methylpropylidene)bis-)
Formula: C6H14 N4 O2
Molecular Weight: 174.24
Synonyms: Urea,1,1'-isobutylidenedi- (7CI,8CI); 1,1-Diureidoisobutane;1,1'-Isobutylidenebisurea; Diureidoisobutane; IBDU; Isobutylenediurea;Isobutylidenebisurea; Isobutylidenediurea; Isodur
EINECS: 228-055-8
Density: 1.18 g/cm3
Melting Point: 195-205ºC
Boiling Point: 309.9 °C at 760 mmHg
Flash Point: 141.2 °C
Solubility: Solubility in water, g/100 ml at 20ºC : 0.2
Appearance: WHITE CRYSTALS.
Hazard Symbols:
Risk Codes:
Safety: Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits toxic fumes of NOx.
Transport Information:
PSA: 110.24000
LogP: 1.48750
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Chemistry

Molecular Structure of Isobutylenediurea (CAS NO. 6104-30-9):

EINECS: 228-055-8
IUPAC Name: [1-(Carbamoylamino)-2-methylpropyl]urea 
Molecular Formula: C6H14N4O2
Molecular Weight: 174.200960 g/mol
XLogP3-AA: -0.8
H-Bond Donor: 4
H-Bond Acceptor: 2
Canonical SMILES: CC(C)C(NC(=O)N)NC(=O)N
InChI: InChI=1S/C6H14N4O2/c1-3(2)4(9-5(7)11)10-6(8)12/h3-4H,1-2H3,(H3,7,9,11)(H3,8,10,12)
InChIKey: QFHMNFAUXJAINK-UHFFFAOYSA-N
Index of Refraction: 1.509
Molar Refractivity: 44.08 cm3
Molar Volume: 147.5 cm3
Surface Tension: 48.6 dyne/cm
Density: 1.18 g/cm3
Flash Point: 141.2 °C
Enthalpy of Vaporization: 55.07 kJ/mol
Boiling Point: 309.9 °C at 760 mmHg
Vapour Pressure: 0.000622 mmHg at 25 °C
Water Solubility: 7.904e+004 mg/L at 25 °C
BRN of Isobutylenediurea (CAS NO. 6104-30-9): 1908981

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits toxic fumes of NOx.

Specification

  Isobutylenediurea with cas registry number of 6104-30-9 is also called for 1,1'-Isobutylidenebisurea ; 1,1-Diureidisobutane ; Diureidoisobutane ; IBDU ; Isobutyldiurea ; Isobutylidenediurea ; Isobutylidene diurea ; Isodur ; N,N''-(2-Methylpropylidene)bisurea ; N,N''-(Isobutylidene)diurea ; Urea, 1,1'-isobutylidenedi- ; Urea, N,N''-(2-methylpropylidene)bis- . It  is widely used in horticulture, turf, etc due to its the performance of a slow-release nitrogen .