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Organic Intermediate
dimethylcyclopentane
CAS:
28729-52-4
MW:
98.19
MF:
C7H14
 
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Names and ldentifier
Other Information
Computational chemical data
Realated Product Infomation
1. Names and Identifiers
1.1 Name
dimethylcyclopentane
1.2 Synonyms
1,2-DIMETHYLCYCLOPENTANE; 1,2-dimethyl-cyclopentane; 1,2-Dimethylcyclopentane #; CIS-1,2-DIMETHYL-CYCLOPENTANE; CTK4F3837; Cyclopentane, 1,2-dimethyl-; Cyclopentane, 1,2-dimethyl-, (1R,2R)-rel-; Cyclopentane, dimethyl-; Dimethylcyclopentane; dimethylcyclopentane;Dimethylcyclopentane; DTXSID80873330; EINECS 219-520-6; EINECS 249-193-5; FT-0694137; FT-0694302; LMFA11000663; MCULE-4820347621; NS00041582;
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1.3 CAS No.
28729-52-4
1.4 CID
17148
1.5 EINECS
249-193-5
1.6 Molecular Formula
C7H14
1.7 Inchi
InChI=1S/C7H14/c1-7(2)5-3-4-6-7/h3-6H2,1-2H3
1.8 InChkey
QWHNJUXXYKPLQM-UHFFFAOYSA-N
1.9 Canonical Smiles
CC1(C)CCCC1
1.10 Isomers Smiles
CC1CCCC1C
2. Computed Properties
Molecular Weight:
98.19g/mol
Molecular Formula:
C
7
H
14
Compound Is Canonicalized:
True
Exact Mass:
3.2
XLogP3-AA:
98.109550447
Monoisotopic Mass:
98.109550447
Complexity:
49.1
Rotatable Bond Count:
0
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
0
Topological Polar Surface Area:
0
Heavy Atom Count::
7
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Isotope Atom Count:
0
Covalently-Bonded Unit Count:
1
CACTVS Substructure Key Fingerprint:
AAADccBgAAAAAAAAAAAAAAAAAAAAAYAAAAAAAAAAAAAAAAAAAAAAGAAAAAAADQCAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAAAEAgAAOgAAAAAAAAAAAAAAAAAAAAAAACAAAAA==
3.Other Information
Definition
ChEBI: 1,2-dimethylcyclopentane is a cycloalkane.
4. Toltal 1 Suppliers
View more
Dayang Chem (Hangzhou) Co., Ltd.
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Update Time:
2024/06/17
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5. Realated Product Infomation
1,1-DIMETHYLCYCLOPENTANE
cas:1638-26-2
1,3-DIMETHYLCYCLOPENTANE
cas:2453-00-1
1,2-Dimethylcyclopentane
cas:2452-99-5
CIS-1,3-DIMETHYLCYCLOPENTANE
cas:2532-58-3
CIS-1,2-DIMETHYLCYCLOPENTANE
cas:1192-18-3
1,3-TRANS-DIMETHYLCYCLOPENTANE
cas:1759-58-6
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.
Computational chemical data
3.
Other Information
4.
Toltal 1 Suppliers
5.
Realated Product Infomation
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