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121825-91-0 | Carbamic acid, N-(4-methoxyphenyl)-N-methyl-, methyl ester
CAS No: 121825-91-0 Catalog No: AG001631 MDL No:
Product Description
Catalog Number:
AG001631
Chemical Name:
Carbamic acid, N-(4-methoxyphenyl)-N-methyl-, methyl ester
CAS Number:
121825-91-0
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
IUPAC Name:
methyl N-[(4-methoxyphenyl)methyl]carbamate
InChI:
InChI=1S/C10H13NO3/c1-13-9-5-3-8(4-6-9)7-11-10(12)14-2/h3-6H,7H2,1-2H3,(H,11,12)
InChI Key:
TVULVQOQHRUOIQ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)N(C(=O)OC)C
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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