Urea, N-1H-benzotriazol-6-yl-N'-phenyl-
Basic information
- CAS
18811-70-6- Standard SMILES
O=C(Nc1ccccc1)Nc1ccc2n[nH]nc2c1- InChIKey
POZVYOVYIZCFLB-UHFFFAOYSA-N- Molecular formula
- C13H11N5O
- Average molar mass
- 253.26 g/mol
- Monoisotopic mass
- 253.09635999
Names & identifiers
- Preferred name
- Urea, N-1H-benzotriazol-6-yl-N'-phenyl-
- IUPAC
- 1-(2H-benzotriazol-5-yl)-3-phenylurea
- English name
- 1-(1H-benzotriazol-5-yl)-3-phenylurea
- Molecular formula
- C13H11N5O
- Molecular weight
- 253.26
Names & synonyms
Urea, N-1H-benzotriazol-5-yl-N'-phenyl-EINECS 242-595-1Urea, N-1H-benzotriazol-6-yl-N'-phenyl-Urea, 1-(1H-benzotriazol-5-yl)-3-phenyl-RefChem:9013201-(1H-Benzotriazol-5-yl)-3-phenylurea18811-70-6N-1H-Benzotriazol-5-yl-N'-phenylurea1-(2H-benzotriazol-5-yl)-3-phenylureaEHS93M44LEDTXSID3066421POZVYOVYIZCFLB-UHFFFAOYSA-N
Show more names
N-(1H-Benzotriazol-5-yl)-N'-phenylurea1-(1H-Benzotriazol-5-yl)-3-phenylharnstoff
5-(3-Phenylureido)-1H-benzotriazoleN-1H-Benzotriazol-6-yl-N'-phenylureaNS00026161N-(1H-1,2,3-Benzotriazol-5-yl)-N'-phenylurea
Database identifiers
- CAS
18811-70-6- PubChem CID
- 87806
- DTXSID
DTXSID3066421- UNII
- EHS93M44LE
- EC Number
- 242-595-1
- Nikkaji
- J222.313I
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 82.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 318
Physicochemical properties
- EPA Substance Registry System
- -1 H-Benzotriazol-5-yl-N'-phenylurea · N-1H-Benzotriazol-5-yl-N'-phenylurea (18811-70-6)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationUrea, N-1H-benzotriazol-6-yl-N'-phenyl-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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