Glycine, N-(4-nitrophenyl)-
Basic information
- CAS
619-91-0- Standard SMILES
O=C(O)CNc1ccc([N+](=O)[O-])cc1- InChIKey
MTRZHSVFAGKMOA-UHFFFAOYSA-N- Molecular formula
- C8H8N2O4
- Average molar mass
- 196.16 g/mol
- Monoisotopic mass
- 196.04840674
Names & identifiers
- Preferred name
- Glycine, N-(4-nitrophenyl)-
- IUPAC
- 2-(4-nitroanilino)acetic acid
- English name
- (4-Nitroanilino)acetic acid
- Molecular formula
- C8H8N2O4
- Molecular weight
- 196.16
Names & synonyms
619-91-0Glycine, N-(4-nitrophenyl)-N-(4-nitrophenyl)glycine2-((4-Nitrophenyl)amino)acetic acid2-[(4-nitrophenyl)amino]acetic acidN-(p-Nitrophenyl)glycineGLYCINE, N-(p-NITROPHENYL)-NSC 32068BRN 2807044AI3-09018DTXSID1060712RefChem:663782
Show more names
p-Nitroanilinoacetic acid
DTXCID0043185800-115-32-(4-nitroanilino)acetic acid(4-nitroanilino)acetic acidMFCD00771958(4-nitrophenyl)glycineNSC320684-Nitrophenyl-glycin
Database identifiers
- CAS
619-91-0- PubChem CID
- 12095
- DTXSID
DTXSID1060712- EC Number
- 800-115-3
- Nikkaji
- J95.076I
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 95.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 218
Physicochemical properties
- Boiling point
- 333.03 °C · 333.03°C (rough estimate)
- Density
- 1.429 · 1.4290 (rough estimate)
- refractive index
- 1.618 · 1.6180 (estimate)
- storage temp.
- Store at Room Tem.
- EPA Substance Registry System
- Glycine, N-(4-nitrophenyl)- (619-91-0)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332
- Precautionary statements
- 260 · P260-P271-P280
- TSCA
- TSCA listed
- HS Code
- 2922498590 · 2922498590
- Toxicity
- 50 ipr-mus: · LD50 ipr-mus: 632 mg/kg JAPMA8 48,419,59
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, 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
- tsca
- TSCA listed
- hs_code
- 2922498590
- Toxicity
- LD50 ipr-mus: 632 mg/kg JAPMA8 48,419,59
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302+H312+H332
- Precautionary statements
- P260-P271-P280
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationGlycine, N-(4-nitrophenyl)-: INACTIVE
Upstream & downstream products
Upstream raw materials
Suppliers
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Related reactions
9 records
Compound notes
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