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54810-63-8 | Methyl 2-chloro-5-methoxybenzoate
CAS No: 54810-63-8 Catalog No: AG003RND MDL No:MFCD12913365
Product Description
Catalog Number:
AG003RND
Chemical Name:
Methyl 2-chloro-5-methoxybenzoate
CAS Number:
54810-63-8
Molecular Formula:
C9H9ClO3
Molecular Weight:
200.6190
MDL Number:
MFCD12913365
IUPAC Name:
methyl 2-chloro-5-methoxybenzoate
InChI:
InChI=1S/C9H9ClO3/c1-12-6-3-4-8(10)7(5-6)9(11)13-2/h3-5H,1-2H3
InChI Key:
OXUBUSSEVOLEPD-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C(=O)OC)Cl
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.024g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.618g/mol
Monoisotopic Mass:
200.024g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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