4,4-methylene bis(cyclohexyl isocyanate) (mixture of isomers)
cyclohexane, 1,1'-methylenebis(4-isocyanato-
 
Notes:
None found
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CAS Number: 5124-30-1Picture of molecule3D/inchi
Other: 103072-21-5
ECHA EINECS - REACH Pre-Reg: 225-863-2
FDA UNII: 4CT385M7K2
Nikkaji Web: J68.774J
Beilstein Number: 2217800
MDL: MFCD00015405
XlogP3-AA: 5.30 (est)
Molecular Weight: 262.35274000
Formula: C15 H22 N2 O2
NMR Predictor: Predict (works with chrome or firefox)
Category: indirect food additives: adhesives and components of coatings
 
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DG SANTE Food Contact Materials: dicyclohexylmethane-4,4'-diisocyanate
FDA Mainterm (IAUFC):5124-30-1 ; 4,4'-METHYLENEBIS(CYCLOHEXYL ISOCYANATE)
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Physical Properties:
Appearance: colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 1.06600 @  25.00 °C.
Refractive Index: 1.49700 @  20.00 °C.
Flash Point: > 230.00 °F. TCC ( > 110.00 °C. )
Soluble in:
 water, 0.1211 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Sigma-Aldrich: Aldrich
For experimental / research use only.
4,4'-Methylenebis(cyclohexyl isocyanate), mixture of isomers
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Safety Information:
Preferred SDS: View
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
oral-rat LD50  9900 mg/kg
BEHAVIORAL: FOOD INTAKE (ANIMAL) GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA" LIVER: OTHER CHANGES
National Technical Information Service. Vol. OTS000555173

Dermal Toxicity:
skin-rabbit LD > 10000 mg/kg
BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: MUSCLE WEAKNESS BEHAVIORAL: FOOD INTAKE (ANIMAL)
National Technical Information Service. Vol. OTS0555173

Inhalation Toxicity:
inhalation-guinea pig LC50 51 mg/m3/1H
LUNGS, THORAX, OR RESPIRATION: CYANOSIS BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES
National Technical Information Service. Vol. OTS0534736

inhalation-rat LCLo 20 ppm/5H
"Documentation of the Threshold Limit Values and Biological Exposure Indices," 5th ed., Cincinnati, OH, American Conference of Governmental Industrial Hygienists, Inc., 1986Vol. 6, Pg. 998, 1991.

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Safety in Use Information:
Category: indirect food additives: adhesives and components of coatings
Recommendation for 4,4-methylene bis(cyclohexyl isocyanate) (mixture of isomers) usage levels up to:
 not for fragrance use.
 
Recommendation for 4,4-methylene bis(cyclohexyl isocyanate) (mixture of isomers) flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
NIOSH Pocket Guide: search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 5124-30-1
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 21202
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 1
 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane
Chemidplus: 0005124301
EPA/NOAA CAMEO: hazardous materials
RTECS: NQ9250000 for cas# 5124-30-1
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References:
 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 5124-30-1
Pubchem (cid): 21202
Pubchem (sid): 134985285
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Other Information:
(IUPAC): Atomic Weights of the Elements 2011 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
FDA Indirect Additives used in Food Contact Substances:View
CHEBI: View
CHEMBL: View
HMDB (The Human Metabolome Database): Search
Export Tariff Code: 2929.10.4000
ChemSpider: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane
bis(4-isocyanatocyclohexyl)methane
 cyclohexane, 1,1'-methylenebis(4-isocyanato-
 dicyclohexylmethane-4,4'-diisocyanate
 hydrogenated MDI
 hylene W
1,1-methylene bis(4-isocyanatocyclohexane)
4,4-methylenebis(cyclohexylisocyanate)
 nacconate H 12
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