3-Allyl-5-methyl-1H-pyrrolo[2,3-b]pyridine - CAS 1198098-45-1
Catalog: |
BB004647 |
Product Name: |
3-Allyl-5-methyl-1H-pyrrolo[2,3-b]pyridine |
CAS: |
1198098-45-1 |
Synonyms: |
5-methyl-3-prop-2-enyl-1H-pyrrolo[2,3-b]pyridine |
IUPAC Name: | 5-methyl-3-prop-2-enyl-1H-pyrrolo[2,3-b]pyridine |
Description: | 3-Allyl-5-methyl-1H-pyrrolo[2,3-b]pyridine (CAS# 1198098-45-1) is a useful research chemical. |
Molecular Weight: | 172.23 |
Molecular Formula: | C11H12N2 |
Canonical SMILES: | CC1=CN=C2C(=C1)C(=CN2)CC=C |
InChI: | InChI=1S/C11H12N2/c1-3-4-9-7-13-11-10(9)5-8(2)6-12-11/h3,5-7H,1,4H2,2H3,(H,12,13) |
InChI Key: | RYTAAURJINNOQG-UHFFFAOYSA-N |
Purity: | 95 % |
MDL: | MFCD13176653 |
LogP: | 2.59980 |
Publication Number | Title | Priority Date |
CN-109206550-A | A kind of hydridization supermolecular mechanism dynamic aggregation object | 20170630 |
CN-109206552-A | A kind of hybrid cross-linked dynamic aggregation object | 20170630 |
CN-109206626-A | A kind of hybrid cross-linked dynamic aggregation object | 20170630 |
CN-109206628-A | A kind of energy-absorbing method based on hybrid cross-linked dynamic aggregation object | 20170630 |
CN-109422835-A | A kind of dynamic aggregation object containing combination supermolecular mechanism | 20170630 |
Complexity: | 191 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.100048391 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.100048391 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 28.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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Pyridines
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