Basic information
- CAS
367501-31-3- Standard SMILES
CCOc1cc(C(=O)O)ccc1N- InChIKey
ZSXBMWHEQHCCRP-UHFFFAOYSA-N- Molecular formula
- C9H11NO3
- Average molar mass
- 181.19 g/mol
- Monoisotopic mass
- 181.07389321
Names & identifiers
- Preferred name
- 4-Amino-3-ethoxybenzoic acid
- IUPAC
- 4-amino-3-ethoxybenzoic acid
- English name
- 4-aMino-3-ethoxybenzoic acid
- Molecular formula
- C9H11NO3
- Molecular weight
- 181.19
Names & synonyms
4-amino-3-ethoxybenzoic acid367501-31-3RefChem:517800816-209-24-Amino-3-ethoxy-benzoic acidMFCD121687204-amino-3-ethoxybenzoicacidSCHEMBL1560918ZSXBMWHEQHCCRP-UHFFFAOYSA-NAKOS009476157PS-11449DB-349103
Show more names
Benzoic acid, 4-amino-3-ethoxy-
EN300-384731AS-813/43502055
Database identifiers
- CAS
367501-31-3- PubChem CID
- 22397448
- EC Number
- 816-209-2
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- form
- fluffy powder
- color
- Off white
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 271 · P271-P261-P280
- HS Code
- 2918290090 · 2918290090
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (100%)；STOT SE 3 (100%)
Safety data
- hs_code
- 2918290090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P271-P261-P280
Chemistry & industry
Suppliers3 total
上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
14 records
Compound notes
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