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1198-96-5 | 2H-1-Benzopyran, 3,4-dihydro-2,2-dimethyl-
CAS No: 1198-96-5 Catalog No: AG000POK MDL No:MFCD00052285
Product Description
Catalog Number:
AG000POK
Chemical Name:
2H-1-Benzopyran, 3,4-dihydro-2,2-dimethyl-
CAS Number:
1198-96-5
Molecular Formula:
C11H14O
Molecular Weight:
162.2283
MDL Number:
MFCD00052285
IUPAC Name:
2,2-dimethyl-3,4-dihydrochromene
InChI:
InChI=1S/C11H14O/c1-11(2)8-7-9-5-3-4-6-10(9)12-11/h3-6H,7-8H2,1-2H3
InChI Key:
MITIYLBEZOKYLX-UHFFFAOYSA-N
SMILES:
CC1(C)CCc2c(O1)cccc2
NSC Number:
63863
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.104g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.232g/mol
Monoisotopic Mass:
162.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Bi(OTf)3-catalysed prenylation of electron-rich aryl ethers and phenols with isoprene: a direct route to prenylated derivatives. | Organic & biomolecular chemistry 20110721 |
| Antihistaminic effect of Bauhinia racemosa leaves. | Journal of young pharmacists : JYP 20110101 |
| New R/S-3,4-dihydro-2,2-dimethyl-6-halo-4-(phenylaminothiocarbonylamino)-2H-1-benzopyrans structurally related to (+/-)-cromakalim as tissue-selective pancreatic beta-cell K(ATP) channel openers. | Bioorganic & medicinal chemistry 20080515 |
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