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850403-67-7 | Cyclopropanemethanol, 2-[(3,4,5-trimethoxyphenyl)methylene]-, (2E)-
CAS No: 850403-67-7 Catalog No: AG004SV3 MDL No:
Product Description
Catalog Number:
AG004SV3
Chemical Name:
Cyclopropanemethanol, 2-[(3,4,5-trimethoxyphenyl)methylene]-, (2E)-
CAS Number:
850403-67-7
Molecular Formula:
C14H18O4
Molecular Weight:
250.2903
IUPAC Name:
[2-[(3,4,5-trimethoxyphenyl)methylidene]cyclopropyl]methanol
InChI:
InChI=1S/C14H18O4/c1-16-12-5-9(4-10-7-11(10)8-15)6-13(17-2)14(12)18-3/h4-6,11,15H,7-8H2,1-3H3
InChI Key:
GZHQYTOXMFUJCD-UHFFFAOYSA-N
SMILES:
OCC1C/C/1=C\c1cc(OC)c(c(c1)OC)OC
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.294g/mol
Monoisotopic Mass:
250.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.5
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