| CAS Number | 70197-77-2 |
| Catalog Number | AG00FEG3 |
| Chemical Name | 1,1-Cyclopropanediacetic acid |
| IUPAC Name | 2-[1-(carboxymethyl)cyclopropyl]acetic acid |
| InChI | InChI=1S/C7H10O4/c8-5(9)3-7(1-2-7)4-6(10)11/h1-4H2,(H,8,9)(H,10,11) |
| InChI Key | ZTHPDQRRMAKLIQ-UHFFFAOYSA-N |
| MDL Number | MFCD17012076 |
| Molecular Formula | C7H10O4 |
| Molecular Weight | 158.1519 |
| SMILES | O=C(O)CC1(CC(O)=O)CC1 |
| Synonyms | 70197-77-2,
2,2'-(CYCLOPROPANE-1,1-DIYL)DIACETIC ACID,
1,1-Cyclopropanediacetic acid,
(1-carboxymethyl-cyclopropyl)-acetic acid,
SCHEMBL9681942,
DTXSID20501524,
ZTHPDQRRMAKLIQ-UHFFFAOYSA-N,
MFCD17012076,
ZINC39242542,
AKOS023202083,
DB-083395,
FT-0728721,
F2147-4379,
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| Complexity | 175 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 158.058g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 158.153g/mol |
| Monoisotopic Mass | 158.058g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 74.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number