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89078-34-2 | Carbamic acid, (3,5-dimethoxyphenyl)-, 1-cyclopropylethyl ester
CAS No: 89078-34-2 Catalog No: AG0040XL MDL No:
Product Description
Catalog Number:
AG0040XL
Chemical Name:
Carbamic acid, (3,5-dimethoxyphenyl)-, 1-cyclopropylethyl ester
CAS Number:
89078-34-2
Molecular Formula:
C14H19NO4
Molecular Weight:
265.3050
IUPAC Name:
1-cyclopropylethyl N-(3,5-dimethoxyphenyl)carbamate
InChI:
InChI=1S/C14H19NO4/c1-9(10-4-5-10)19-14(16)15-11-6-12(17-2)8-13(7-11)18-3/h6-10H,4-5H2,1-3H3,(H,15,16)
InChI Key:
PYNFQCOYRDBCME-UHFFFAOYSA-N
SMILES:
COc1cc(NC(=O)OC(C2CC2)C)cc(c1)OC
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.131g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.309g/mol
Monoisotopic Mass:
265.131g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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