Basic information
- Standard SMILES
Cl.N=C(S)NCc1ccccc1- InChIKey
BYBRLWJURWATSG-UHFFFAOYSA-N- Molecular formula
- C8H11ClN2S
- Average molar mass
- 202.71 g/mol
- Monoisotopic mass
- 202.0331472
Names & identifiers
- Preferred name
- Benzylthiourea hydrochloride
- IUPAC
- benzylthiourea;hydrochloride
Names & synonyms
BENZYLTHIOUREA HYDROCHLORIDE89410-45-7benzylthiourea;hydrochloride1-benzylthiourea hydrochlorideSCHEMBL4003812SCHEMBL4003818SCHEMBL4474844BenzylisothioharnstoffhydrochloridBENZYLTHIOUREAHYDROCHLORIDEBYBRLWJURWATSG-UHFFFAOYSA-NEBC-247045DB-375077
Show more names
EN300-82419
Database identifiers
- PubChem CID
- 22451103
Properties
Computed structural properties
- Topological polar surface area
- 70.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 130
Related reactions
1 records
Compound notes
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