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736158-14-8 | 2H-Pyran, 2-[[(1S)-2-(bromomethyl)-1-methyl-2-propenyl]oxy]tetrahydro-
CAS No: 736158-14-8 Catalog No: AG005C4Z MDL No:
Product Description
Catalog Number:
AG005C4Z
Chemical Name:
2H-Pyran, 2-[[(1S)-2-(bromomethyl)-1-methyl-2-propenyl]oxy]tetrahydro-
CAS Number:
736158-14-8
Molecular Formula:
C10H17BrO2
Molecular Weight:
249.1448
IUPAC Name:
2-[(2S)-3-(bromomethyl)but-3-en-2-yl]oxyoxane
InChI:
InChI=1S/C10H17BrO2/c1-8(7-11)9(2)13-10-5-3-4-6-12-10/h9-10H,1,3-7H2,2H3/t9-,10?/m0/s1
InChI Key:
ZCEBQDZNPCDVMJ-RGURZIINSA-N
SMILES:
BrCC(=C)[C@@H](OC1CCCCO1)C
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
248.041g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.148g/mol
Monoisotopic Mass:
248.041g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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