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Details

Stereochemistry ACHIRAL
Molecular Formula C8H13NO
Molecular Weight 139.1949
Optical Activity NONE
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 1-Isocyanato-4-methylcyclohexane, trans-

SMILES

C[C@H]1CC[C@@H](CC1)N=C=O

InChI

InChIKey=SWSXEZOUBBVKCO-ZKCHVHJHSA-N
InChI=1S/C8H13NO/c1-7-2-4-8(5-3-7)9-6-10/h7-8H,2-5H2,1H3/t7-,8-

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
1-Isocyanato-4-methylcyclohexane, trans-
Systematic Name English
Isocyanic acid, 4-methylcyclohexyl ester, trans-
Systematic Name English
Cyclohexane, 1-isocyanato-4-methyl-, trans-
Systematic Name English
trans-4-Methylcyclohexyl isocyanate
Systematic Name English
trans-1-Isocyanato-4-methylcyclohexane
Systematic Name English
Code System Code Type Description
CAS
32175-00-1
Created by admin on Sat Dec 16 19:15:49 GMT 2023 , Edited by admin on Sat Dec 16 19:15:49 GMT 2023
PRIMARY
FDA UNII
3P79HS8WQB
Created by admin on Sat Dec 16 19:15:49 GMT 2023 , Edited by admin on Sat Dec 16 19:15:49 GMT 2023
PRIMARY
NIH
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