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27389-84-0 | 2-[(4-HYDROXY-3-IODO-5-METHOXYPHENYL)METHYLENE]MALONONITRILE
CAS No: 27389-84-0 Catalog No: AG00BCQD MDL No:
Product Description
Catalog Number:
AG00BCQD
Chemical Name:
2-[(4-HYDROXY-3-IODO-5-METHOXYPHENYL)METHYLENE]MALONONITRILE
CAS Number:
27389-84-0
IUPAC Name:
2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]propanedinitrile
InChI:
InChI=1S/C11H7IN2O2/c1-16-10-4-7(2-8(5-13)6-14)3-9(12)11(10)15/h2-4,15H,1H3
InChI Key:
BZIXGOBJBFWPTF-UHFFFAOYSA-N
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.955g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
326.093g/mol
Monoisotopic Mass:
325.955g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
77A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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