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1862606-37-8 | 3-(4-iodophenyl)-3-methyloxirane-2-carbonitrile
CAS No: 1862606-37-8 Catalog No: AG01C6OF MDL No:MFCD30147767
Product Description
Catalog Number:
AG01C6OF
Chemical Name:
3-(4-iodophenyl)-3-methyloxirane-2-carbonitrile
CAS Number:
1862606-37-8
Molecular Formula:
C10H8INO
Molecular Weight:
285.0811
MDL Number:
MFCD30147767
IUPAC Name:
3-(4-iodophenyl)-3-methyloxirane-2-carbonitrile
InChI:
InChI=1S/C10H8INO/c1-10(9(6-12)13-10)7-2-4-8(11)5-3-7/h2-5,9H,1H3
InChI Key:
QVOMYIGLYKCRLM-UHFFFAOYSA-N
SMILES:
N#CC1OC1(C)c1ccc(cc1)I
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.965g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.084g/mol
Monoisotopic Mass:
284.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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