| CAS Number | 917025-00-4 |
| Catalog Number | AG00IGUI(AGN-PC-0WNOBP) |
| Chemical Name | Ethyl 2-(2-chloropyrimidin-5-yl)acetate |
| IUPAC Name | ethyl 2-(2-chloropyrimidin-5-yl)acetate |
| InChI | InChI=1S/C8H9ClN2O2/c1-2-13-7(12)3-6-4-10-8(9)11-5-6/h4-5H,2-3H2,1H3 |
| InChI Key | RTSBRQPXTQXJFJ-UHFFFAOYSA-N |
| MDL Number | MFCD18416528 |
| Molecular Formula | C8H9ClN2O2 |
| Molecular Weight | 200.6223 |
| SMILES | O=C(OCC)CC1=CN=C(Cl)N=C1 |
| Synonyms | ethyl 2-(2-chloropyrimidin-5-yl)acetate,
917025-00-4,
SCHEMBL1525168,
RTSBRQPXTQXJFJ-UHFFFAOYSA-N,
Ethyl 2-chloropyrimidine-5-acetate,
MFCD18416528,
ZINC90225706,
AKOS025291268,
NE56183,
SB23013,
AS-51313,
CS-0049540,
KS-00000809,
(2-chloro-pyrimidin-5-yl)acetic acid ethyl ester,
(2-chloro-pyrimidin-5-yl)-acetic Acid Ethyl Ester,
Z1924087022,
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| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.622g/mol |
| Monoisotopic Mass | 200.035g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 52.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number