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1587-04-8 | Benzene, 1-methyl-2-(2-propen-1-yl)-
CAS No: 1587-04-8 Catalog No: AG001QRW MDL No:MFCD00060911
Product Description
Catalog Number:
AG001QRW
Chemical Name:
Benzene, 1-methyl-2-(2-propen-1-yl)-
CAS Number:
1587-04-8
Molecular Formula:
C10H12
Molecular Weight:
132.2023
MDL Number:
MFCD00060911
IUPAC Name:
1-methyl-2-prop-2-enylbenzene
InChI:
InChI=1S/C10H12/c1-3-6-10-8-5-4-7-9(10)2/h3-5,7-8H,1,6H2,2H3
InChI Key:
SVIHJJUMPAUQNO-UHFFFAOYSA-N
SMILES:
C=CCc1ccccc1C
NSC Number:
73972
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.094g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.206g/mol
Monoisotopic Mass:
132.094g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Literature
| Title | Journal |
|---|---|
| Ring-opening of aziridine-2-carboxamides with carbohydrate C1-O-nucleophiles. Stereoselective preparation of alpha- and beta-O-glycosyl serine conjugates. | Journal of the American Chemical Society 20081119 |
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