Basic information
- CAS
923233-37-8- Standard SMILES
Cc1ccc(CNC(=O)NCC(=O)O)cc1- InChIKey
DVIGRUODSYLGBK-UHFFFAOYSA-N- Molecular formula
- C11H14N2O3
- Average molar mass
- 222.24 g/mol
- Monoisotopic mass
- 222.10044231
Names & identifiers
- Preferred name
- ({[(4-Methylbenzyl)amino]carbonyl}amino)acetic acid
- IUPAC
- 2-[(4-methylphenyl)methylcarbamoylamino]acetic acid
- English name
- ([[(4-METHYLBENZYL)AMINO]CARBONYL]AMINO)ACETIC ACID
- Molecular formula
- C11H14N2O3
- Molecular weight
- 222.24
Names & synonyms
923233-37-82-({[(4-methylphenyl)methyl]carbamoyl}amino)acetic acid({[(4-methylbenzyl)amino]carbonyl}amino)acetic acid2-(3-(4-Methylbenzyl)ureido)acetic acid([[(4-methylbenzyl)amino]carbonyl]amino)acetic acid2-[(4-methylphenyl)methylcarbamoylamino]acetic acid(([(4-METHYLBENZYL)AMINO]CARBONYL)AMINO)ACETIC ACID((4-METHYLBENZYL)CARBAMOYL)GLYCINE2-[3-(4-Methylbenzyl)ureido]acetic AcidGlycine, N-[[[(4-methylphenyl)methyl]amino]carbonyl]-MFCD08691370AKOS000200808
Show more names
N-[[[(4-Methylphenyl)methyl]amino]carbonyl]glycine
2-(3-(4-Methylbenzyl)ureido)aceticacidSY1689802-(p-tolylmethylcarbamoylamino)acetic acidDB-353169CS-0243550EN300-26539G36910F659096
Database identifiers
- CAS
923233-37-8- PubChem CID
- 16227635
- EC Number
- 160-766-8
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 248
Physicochemical properties
- Boiling point
- 511.7 · 511.7±43.0 °C(Predicted)
- Density
- 1.228 · 1.228±0.06 g/cm3(Predicted)
- pka
- 4.11 · 4.11±0.10(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers2 total
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…