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CIS,CIS,TRANS-1,3,5-TRIMETHYLCYCLOHEXANE
CAS:
1795-26-2
MW:
126.23922
MF:
C9H18
 
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Names and ldentifier
Msds
Computational chemical data
Realated Product Infomation
1. Names and Identifiers
1.1 Name
CIS,CIS,TRANS-1,3,5-TRIMETHYLCYCLOHEXANE
1.2 Synonyms
1,3(Z),5(E)-Trimethylcyclohexane; 1,cis-3,trans-5-Trimethylcyclohexane; 1-trans-3,5-Trimethylcyclohexane; CIS,CIS,TRANS-1,3,5-TRIMETHYLCYCLOHEXANE; cis,trans-1,3,5-trimethylcyclohexane; Cyclohexane, 1,3,5-trimethyl-, (1alpha,3alpha,5beta)-; Cyclohexane, 1,3,5-trimethyl-, trans-;
1.3 CAS No.
1795-26-2
1.4 CID
35364
1.5 EINECS
217-417-0
1.6 Molecular Formula
C9H18
1.7 Inchi
InChI=1S/C9H18/c1-7-4-8(2)6-9(3)5-7/h7-9H,4-6H2,1-3H3
1.8 InChkey
ODNRTOSCFYDTKF-UHFFFAOYSA-N
1.9 Canonical Smiles
CC1CC(CC(C1)C)C
1.10 Isomers Smiles
CC1CC(CC(C1)C)C
2. MSDS
2.
Hazard identification
2.1
Classification of the substance or mixture
no data available
2.2
GHS label elements, including precautionary statements
Pictogram(s)
no data available
Signal word
no data available
Hazard statement(s)
no data available
Precautionary statement(s)
Prevention
no data available
Response
no data available
Storage
no data available
Disposal
no data available
2.3
Other hazards which do not result in classification
no data available
View all
3. Synthesis Route
1795-26-2
Total: 2 Synthesis Route
108-67-8
97 Suppliers
1795-26-2
2 Suppliers
1795-27-3
4 Suppliers
3643-64-9
1795-26-2
2 Suppliers
1795-27-3
4 Suppliers
4. Precursor and Product
precursor:
3643-64-9
108-67-8
5. Computed Properties
Molecular Weight:
126.23922g/mol
Molecular Formula:
C
9
H
18
Compound Is Canonicalized:
True
Exact Mass:
4
XLogP3-AA:
126.140850574
Monoisotopic Mass:
126.140850574
Complexity:
55
Rotatable Bond Count:
0
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
0
Topological Polar Surface Area:
0
Heavy Atom Count::
9
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Isotope Atom Count:
0
Covalently-Bonded Unit Count:
1
CACTVS Substructure Key Fingerprint:
AAADceBwAAAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAAAAAAAGAAAAAAADQCAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAAAEAgEAOAAAAAAAAAAAAAAQAAAAAAAAAAAAAAA==
6. Toltal 2 Suppliers
View more
ChemSampCo, Inc.
Tel:
Update Time:
2019/11/25
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Carbone scientific
Tel:
Update Time:
2022/01/01
inquire
7. Realated Product Infomation
CIS,TRANS,CIS-1,2,4-TRIMETHYLCYCLOHEXANE
cas:7667-59-6
CIS,CIS,TRANS-1,2,4-TRIMETHYLCYCLOHEXANE
cas:7667-58-5
CIS,TRANS,CIS-1,2,3-TRIMETHYLCYCLOHEXANE
cas:1839-88-9
CIS,TRANS,TRANS-1,2,4-TRIMETHYLCYCLOHEXANE
cas:1678-80-4
CIS,TRANS,TRANS-1,2,4-TRIMETHYLCYCLOHEXANE
cas:7667-60-9
CIS,CIS,CIS-1,3,5-TRIMETHYLCYCLOHEXANE
cas:1795-27-3
1. Names and Identifiers
1.1 Name
1.2 Synonyms
1.3 CAS No.
1.4 EINECS(EC#)
1.5 Molecular Formula
1.6 Inchi
1.7 InChkey
1.8 Canonical Smiles
1.9 Isomers Smiles
2.
Msds
3.
Synthesis Route
4.
Precursor and Product
5.
Computational chemical data
6.
Toltal 2 Suppliers
7.
Realated Product Infomation
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