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126917-44-0 | Benzene, 1-(2-chloro-1-methylenepropyl)-2,4-difluoro-, (R)- (9CI)
CAS No: 126917-44-0 Catalog No: AG000TGZ MDL No:
Product Description
Catalog Number:
AG000TGZ
Chemical Name:
Benzene, 1-(2-chloro-1-methylenepropyl)-2,4-difluoro-, (R)- (9CI)
CAS Number:
126917-44-0
Molecular Formula:
C10H9ClF2
Molecular Weight:
202.6283
IUPAC Name:
1-(3-chlorobut-1-en-2-yl)-2,4-difluorobenzene
InChI:
InChI=1S/C10H9ClF2/c1-6(7(2)11)9-4-3-8(12)5-10(9)13/h3-5,7H,1H2,2H3
InChI Key:
HUBSGDKELUJNGA-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)F)C(=C)[C@H](Cl)C
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.036g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.629g/mol
Monoisotopic Mass:
202.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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