Basic information
- CAS
607-96-5- Standard SMILES
Cc1cc(O)cc(O)c1N=Nc1ccc([N+](=O)[O-])cc1- InChIKey
XDOOUKIUNUWEFT-UHFFFAOYSA-N- Molecular formula
- C13H11N3O4
- Average molar mass
- 273.24 g/mol
- Monoisotopic mass
- 273.07495584
Names & identifiers
- Preferred name
- 5-Methyl-4-(4-nitrophenylazo)resorcinol
- IUPAC
- 5-methyl-4-[(4-nitrophenyl)diazenyl]benzene-1,3-diol
- English name
- 4-Nitrobenzene-AZO-orcinol
- Molecular formula
- C13H11N3O4
- Molecular weight
- 273.24
Names & synonyms
5-Methyl-4-(4-nitrophenylazo)resorcinol5-Methyl-4-[2-(4-nitrophenyl)diazenyl]-1,3-benzenediol5-Methyl-4-(2-(4-nitrophenyl)diazenyl)-1,3-benzenediolRefChem:537128210-150-0607-96-54-Nitrobenzene-azo-orcinol4-(4-Nitrophenylazo)orcinol1,3-Benzenediol, 5-methyl-4-[(4-nitrophenyl)azo]-2,4-Dihydroxy-6-methyl-4'-nitroazobenzeneNSC50665-methyl-4-[(4-nitrophenyl)diazenyl]benzene-1,3-diol
Show more names
P-NITROBENZENEAZOORCINOL4-(P-NITROPHENYLAZO)ORCINOL4-(4-Nitrophenylazo)orcinol>5-Methyl-4-(4-nitrophenylazo)resorcin4-(4-NITROPHENYLAZO)-5-METHYLRESORCINOL4-[(p-Nitrophenyl)azo]-5-Methylresorcinol5-METHYL-4-[(P-NITROPHENYL)AZO]RESORCINOL
5-methyl-4-[2-(4-nitrophenyl)diazen-1-yl]benzene-1,3-diolNSC-5066MFCD000147101,3-Benzenediol, 5-methyl-4-((4-nitrophenyl)azo)-1,3-Benzenediol, 5-methyl-4-(2-(4-nitrophenyl)diazenyl)-1,3-Benzenediol, 5-methyl-4-[2-(4-nitrophenyl)diazenyl]-Beryllon INSC 5066
Database identifiers
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 363
Physicochemical properties
- EPA Substance Registry System
- 1 · 1,3-Benzenediol, 5-methyl-4-[(4-nitrophenyl)azo]- (607-96-5)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H317
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P305+P351+P338-P337+P313P
- TSCA
- TSCA listed
- HS Code
- 2927 · 2927.00.5000
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
H317 (97.5%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P264+P265, P272, P280, P302+P352, P305+P351+P338, P321, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Sens. 1 (97.5%)
Safety data
- tsca
- TSCA listed
- hs_code
- 2927.00.5000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H317
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3-Benzenediol, 5-methyl-4-[2-(4-nitrophenyl)diazenyl]-: INACTIVE
Suppliers41 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海康朗生物科技有限公司021-61998208 18217752821 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
广东谦进化学试剂有限公司0751-2818792 13435114148 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
四川库利南科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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