Basic information
- CAS
61161-83-9- Standard SMILES
O=[N+]([O-])c1ccc(CO)cc1O- InChIKey
YDFRYKXELURVHE-UHFFFAOYSA-N- Molecular formula
- C7H7NO4
- Average molar mass
- 169.13 g/mol
- Monoisotopic mass
- 169.0375077
Names & identifiers
- Preferred name
- 5-(Hydroxymethyl)-2-nitrophenol
- IUPAC
- 5-(hydroxymethyl)-2-nitrophenol
- English name
- 5-(hydroxymethyl)-2-nitrophenol
- Molecular formula
- C7H7NO4
- Molecular weight
- 169.13
Names & synonyms
5-(HYDROXYMETHYL)-2-NITROPHENOL61161-83-9DTXSID70561239RefChem:300513DTXCID00512017837-550-33-hydroxy-4-nitrobenzyl alcoholMFCD000863425-Hydroxymethyl-2-nitrophenolSCHEMBL23452665-Hydroxymethyl 2-Nitro phenolYDFRYKXELURVHE-UHFFFAOYSA-N
Show more names
3-(Hydroxymethyl)-6-nitrophenol3-Hydroxy-4-nitrobenzenemethanolBENZENEMETHANOL, 3-HYDROXY-4-NITRO-
5-(hydroxymethyl)-2-nitro-phenolCS-M0515LCA16183GEO-01718AKOS011394119AS-47398SY165939EN300-190260
Database identifiers
- CAS
61161-83-9- PubChem CID
- 14520114
- DTXSID
DTXSID70561239- EC Number
- 837-550-3
- Nikkaji
- J886.613I
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 86.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 167
Physicochemical properties
- storage temp.
- 2 · Storage temp. 2-8°C
- Appearance
- Light yellow to yellow Solid
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H315-H318-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P330-P332+P313-P362-P403+P233-P405-P501
Safety & regulation
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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 CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- Hazard statements
- H302-H315-H318-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P330-P332+P313-P362-P403+P233-P405-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers23 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
上海皓之翔生物科技有限公司（原上海拓青化工有限公司）526763801 13301653310 · [email protected]
上海威芬奇医药科技有限公司13817485796 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
苏州施亚生物科技有限公司0512-0512-52358471 17715136450 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
Related reactions
8 records
Compound notes
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