Basic information
- CAS
90918-65-3- Standard SMILES
Cc1ccc(CN(CC(=O)O)N=O)cc1- InChIKey
LHLOZDRHLKUFFW-UHFFFAOYSA-N- Molecular formula
- C10H12N2O3
- Average molar mass
- 208.21 g/mol
- Monoisotopic mass
- 208.08479225
Names & identifiers
- Preferred name
- 2-[(4-Methylphenyl)methyl-nitroso-amino]acetic acid
- IUPAC
- 2-[(4-methylphenyl)methyl-nitrosoamino]acetic acid
- English name
- 2-[(4-methylphenyl)methyl-nitroso-amino]acetic acid
- Molecular formula
- C10H12N2O3
- Molecular weight
- 0
Names & synonyms
90918-65-32-[(4-METHYLPHENYL)METHYL-NITROSO-AMINO]ACETIC ACIDNSC52852DTXSID20287851NSC-52852{[(4-METHYLPHENYL)METHYL](NITROSO)AMINO}ACETIC ACID2-((4-methylbenzyl)(nitroso)amino)acetic acid
Database identifiers
- CAS
90918-65-3- PubChem CID
- 243299
- DTXSID
DTXSID20287851
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 70 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 225
Chemistry & industry
Suppliers1 total
上海康满林生物医药有限公司68080707 15021879576 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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