Basic information
- CAS
553-00-4- Standard SMILES
CC(=O)O.Nc1ccc2ccccc2c1- InChIKey
IHTSMKSDNSSELM-UHFFFAOYSA-N- Molecular formula
- C12H13NO2
- Average molar mass
- 203.24 g/mol
- Monoisotopic mass
- 203.09462866
Overview
See also: Salts of 2-naphthylamine (annotation moved to).
Names & identifiers
- Preferred name
- 2-Naphthylammonium acetate
- IUPAC
- acetic acid;naphthalen-2-amine
- English name
- 2-naphthylammonium acetate
- Molecular formula
- C12H13NO2
- Molecular weight
- 203.24
Names & synonyms
2-Naphthylammonium acetateEINECS 209-030-0RefChem:477130209-030-0553-00-4acetic acid;naphthalen-2-amineNaphthalen-2-amine acetateSCHEMBL27635352DTXSID00970618IHTSMKSDNSSELM-UHFFFAOYSA-Nbeta-Naphthylamine Acetate_x000D_Acetic acid--naphthalen-2-amine (1/1)
Show more names
β-Naphthylamine Acetate DISCONTINUED PLEASE SEE N378010
AS-58682DISCONTINUED PLEASE SEE N378010
Database identifiers
- CAS
553-00-4- PubChem CID
- 71097
- DTXSID
DTXSID00970618- EC Number
- 209-030-0
Properties
Computed structural properties
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 164
Physicochemical properties
- InChI
- InChI=1S/C10H9N.C2H4O2/c11-10-6-5-8-3-1-2-4-9(8)7-10;1-2(3)4/h1-7H,11H2;1H3,(H,3,4)
- InChIKey
- IHTSMKSDNSSELM-UHFFFAOYSA-N
- SMILES
- C(=O)(O)C.NC1C=CC2=CC=CC=C2C=1
- REACH Annex XVII Substances List
- 2 · 2-naphthylammonium acetate (553-00-4)
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
Danger
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P203, P264, P270, P273, P280, P301+P317, P318, P330, P391, P405, and P501 (click each P-code to see the statement)
Hazard information
Regulatory Information
Hazard Traits - Carcinogenicity
Restricted substance: 2-naphthylammonium acetate
Hazard Classes and CategoriesCarcinogenicity - category 1A
Chemistry & industry
Suppliers26 total
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
武汉问津化学科技有限公司13517196568 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
湖北成海化工有限公司027-59220433 18327245847 · [email protected]
上海亚毓生物医药有限公司021-54370211 18051886391 · [email protected]
Qingdao Dexin Chemical Co., Ltd+86-15553333686 · [email protected]
常州安奈凯医药科技有限公司+86-0519-8359-8696 · [email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
湖北齐飞医药化工有限公司027-59322506 18071128681 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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