Completing data — usually done within a minute
Basic information
- CAS
21076-09-5- Standard SMILES
CN(N)C(=S)Nc1ccccc1- InChIKey
YZGLZXFPFUCNQE-UHFFFAOYSA-N- Molecular formula
- C8H11N3S
- Average molar mass
- 181.26 g/mol
- Monoisotopic mass
- 181.06736835
Names & identifiers
- Preferred name
- Sbb062267
- IUPAC
- 1-amino-1-methyl-3-phenylthiourea
Names & synonyms
21076-09-5SBB062267DTXSID30357453RefChem:379999DTXCID403085123-amino-3-methyl-1-phenylthiourea1-Methyl-N-phenylhydrazine-1-carbothioamide1-phenyl-3-methylthiosemicarbazide2-methyl-4-phenylthiosemicarbazideMFCD002273871-amino-1-methyl-3-phenylthiourea1-amino-1-methyl-3-phenyl-thiourea
Show more names
NSC231525SCHEMBL10670402YZGLZXFPFUCNQE-UHFFFAOYSA-NHMS1784N18AKOS0010192941-amino-1-methyl-3-phenyl-isothiourea2-Methyl-4-phenyl-3-thiosemicarbazideMS-8592
Database identifiers
- CAS
21076-09-5- PubChem CID
- 853583
- DTXSID
DTXSID30357453- Nikkaji
- J316.061K
Properties
Computed structural propertiesFilling in
- XLogP
- 0.3
- Topological polar surface area
- 73.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 154
Related reactions
6 records
Compound notes
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