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Basic information
- CAS
145547-97-3- Standard SMILES
O=[N+]([O-])c1cc(CO)ccc1Br- InChIKey
GAANESYOLGFJFC-UHFFFAOYSA-N- Molecular formula
- C7H6BrNO3
- Average molar mass
- 232.03 g/mol
- Monoisotopic mass
- 230.95310515
Names & identifiers
- Preferred name
- (4-Bromo-3-nitrophenyl)methanol
- IUPAC
- (4-bromo-3-nitrophenyl)methanol
- English name
- 4-bromo-3-nitroBenzenemethanol
- Molecular formula
- C7H6BrNO3
- Molecular weight
- 232.03
Names & synonyms
145547-97-3(4-bromo-3-nitrophenyl)methanol4-bromo-3-nitrobenzyl alcoholBenzenemethanol, 4-bromo-3-nitro-MFCD080591324-bromo-3-nitrobenzylalcoholSCHEMBL279049SCHEMBL16960708DTXSID60647410GAANESYOLGFJFC-UHFFFAOYSA-N(4-bromo-3-nitro-phenyl)methanolVFA54797
Show more names
4-bromo-3-nitroBenzenemethanol2,4-Dichlorobenzyl Alcohol Impurity 34
(4-Bromo-3-nitro-phenyl)-methanolAKOS009116116AB14524DA-10185CS-0334059EN300-183123F539893
Database identifiers
- CAS
145547-97-3- PubChem CID
- 24809228
- DTXSID
DTXSID60647410
Properties
Computed structural propertiesFilling in
- XLogP
- 1.6
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 171
Physicochemical properties
- Melting point
- 61 · 61-62 °C
- Boiling point
- 338.5 · 338.5±27.0 °C(Predicted)
- Density
- 1.767 · 1.767±0.06 g/cm3(Predicted)
- pka
- 13.43 · 13.43±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2906290090 · 2906290090
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
- hs_code
- 2906290090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers17 total
苏州亚衍医药科技有限公司17715136450 · [email protected]
常州环灵化工有限公司89803005 18206112582 · [email protected]
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
山东轩鸿生物医药有限公司+86-0531-88801869 15090917080 · [email protected]
山东利腾生物科技有限公司15020019777 18663721413 · [email protected]
上海润栖医药科技有限公司021-38751876 15000076078 · [email protected]
上海百韧生物科技有限公司13564638271 · [email protected]
上海安米克化学品有限公司微信：18019252918 18019252918 · [email protected]
山东鸿图生物科技有限公司15318761660 15966937598 · [email protected]
常州安赛普化工有限公司0519-86305871 · [email protected]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
山东轩鸿生物医药有限公司天桥分公司0531-88801869 15090917080 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
Related reactions
3 records
Compound notes
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