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Home > Other Heterocycles > 148054-42-6
148054-42-6 | Bicyclo[2.2.1]hepta-2,5-diene-2-carbonyl chloride, 3-methoxy-
CAS No: 148054-42-6 Catalog No: AG001FEQ MDL No:
Product Description
Catalog Number:
AG001FEQ
Chemical Name:
Bicyclo[2.2.1]hepta-2,5-diene-2-carbonyl chloride, 3-methoxy-
CAS Number:
148054-42-6
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
IUPAC Name:
3-methoxybicyclo[2.2.1]hepta-2,5-diene-2-carbonyl chloride
InChI:
InChI=1S/C9H9ClO2/c1-12-8-6-3-2-5(4-6)7(8)9(10)11/h2-3,5-6H,4H2,1H3
InChI Key:
AHCRARMPVQLWCV-UHFFFAOYSA-N
SMILES:
COC1=C(C(=O)Cl)C2CC1C=C2
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.029g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.619g/mol
Monoisotopic Mass:
184.029g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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