Basic information
- CAS
2989-98-2- Standard SMILES
NC(=O)Nc1cccc(Br)c1- InChIKey
DHMRSMNEKFDABI-UHFFFAOYSA-N- Molecular formula
- C7H7BrN2O
- Average molar mass
- 215.05 g/mol
- Monoisotopic mass
- 213.97418
Names & identifiers
- Preferred name
- 3-Bromophenylurea
- IUPAC
- (3-bromophenyl)urea
- English name
- 3-BROMOPHENYLUREA
- Molecular formula
- C7H7BrN2O
- Molecular weight
- 215.05
Names & synonyms
3-BROMOPHENYLUREA(3-bromophenyl)ureaUrea, (3-bromophenyl)-UNII-02R6NPO62702R6NPO627AI3-61351DTXSID70184008RefChem:93256DTXCID40106499839-506-92989-98-21-(3-Bromophenyl)Urea
Show more names
BUTTPARK 120\07-553-Bromophenylurea,97%3-Ureido-1-bromobenzene
N-(3-Bromophenyl)ureaMFCD00041317amino-N-(3-bromophenyl)amide3-Bromopheylurea(m-Bromophenyl)ureaN-3-bromophenyl ureaSCHEMBL167814DHMRSMNEKFDABI-UHFFFAOYSA-N
Database identifiers
- CAS
2989-98-2- PubChem CID
- 18129
- DTXSID
DTXSID70184008- UNII
- 02R6NPO627
- EC Number
- 839-506-9
- Nikkaji
- J308.145A
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 151
Experimental & physicochemical properties
LogP2.08
Physicochemical properties
- Melting point
- 166 · 166-168°C
- Boiling point
- 289 ℃ · 289℃
- Density
- 1.708 · 1.708
- Flash point
- 128 ℃ · 128℃
- storage temp.
- 2 · 2-8°C
- BRN
- 2718463 · 2718463
- CAS DataBase Reference
- 2989 · 2989-98-2
- FDA UNII
- 2 R6NPO627 · 02R6NPO627
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Safety Statements
- 22 · 22-24/25
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2924210090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers21 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Syntechem Co.,Ltd[email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海裕兰生物科技有限公司021-57171705 13817537615 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
Related reactions
2 records
Compound notes
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