| CAS Number | 35404-63-8 |
| Catalog Number | AG007CFL(AGN-PC-0JD5IG) |
| Chemical Name | Glycine, N-(aminoiminomethyl)-N-(phenylmethyl)- |
| IUPAC Name | 2-[benzyl(carbamimidoyl)amino]acetic acid |
| InChI | InChI=1S/C10H13N3O2/c11-10(12)13(7-9(14)15)6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H3,11,12)(H,14,15) |
| InChI Key | DRCHOONPCUVLOU-UHFFFAOYSA-N |
| MDL Number | MFCD24488052 |
| Molecular Formula | C10H13N3O2 |
| Molecular Weight | 207.2291 |
| NSC Number | 244820 |
| SMILES | O=C(O)CN(C(N)=N)CC1=CC=CC=C1 |
| Synonyms | 2-(1-Benzylguanidino)acetic acid,
35404-63-8,
NSC244820,
AC1L7U2N,
SCHEMBL20399691,
ADAL1044297,
AKOS030601846,
2-(N-benzylcarbamimidamido)acetic acid,
NSC-244820,
2-[benzyl(carbamimidoyl)amino]acetic acid,
CID316537,
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| Complexity | 237 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.233g/mol |
| Monoisotopic Mass | 207.101g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 90.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
Lot Number