Methyl 2-[(Dimethylamino)methyl]benzoate - CAS 27171-87-5
Catalog: |
BB019488 |
Product Name: |
Methyl 2-[(Dimethylamino)methyl]benzoate |
CAS: |
27171-87-5 |
Synonyms: |
2-[(dimethylamino)methyl]benzoic acid methyl ester; methyl 2-[(dimethylamino)methyl]benzoate |
IUPAC Name: | methyl 2-[(dimethylamino)methyl]benzoate |
Description: | Methyl 2-[(Dimethylamino)methyl]benzoate (CAS# 27171-87-5) is a useful research chemical. |
Molecular Weight: | 193.24 |
Molecular Formula: | C11H15NO2 |
Canonical SMILES: | CN(C)CC1=CC=CC=C1C(=O)OC |
InChI: | InChI=1S/C11H15NO2/c1-12(2)8-9-6-4-5-7-10(9)11(13)14-3/h4-7H,8H2,1-3H3 |
InChI Key: | CSESFGWHSGKBDU-UHFFFAOYSA-N |
LogP: | 1.53480 |
Publication Number | Title | Priority Date |
TW-200418835-A | A pyrazolopyrimidine compound and a process for preparing the same | 20030124 |
Complexity: | 192 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.110278721 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.110278721 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 29.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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