Basic information
- CAS
1214-48-8- Standard SMILES
Nc1ccccc1C(=O)NCc1cccnc1- InChIKey
VQCAHUSKECKWPX-UHFFFAOYSA-N- Molecular formula
- C13H13N3O
- Average molar mass
- 227.26 g/mol
- Monoisotopic mass
- 227.10586205
Names & identifiers
- Preferred name
- 2-amino-N-[(pyridin-3-yl)methyl]benzamide
- IUPAC
- 2-amino-N-(pyridin-3-ylmethyl)benzamide
- English name
- 2-AMINO-N-(PYRIDIN-3-YLMETHYL)BENZAMIDE
- Molecular formula
- C13H13N3O
- Molecular weight
- 227.26
Names & synonyms
2-amino-N-[(pyridin-3-yl)methyl]benzamide2-amino-N-((pyridin-3-yl)methyl)benzamideRefChem:464925868-213-92-amino-N-(pyridin-3-ylmethyl)benzamide1214-48-82-amino-N-(3-pyridinylmethyl)benzamideMFCD00118372benzamide, 2-amino-N-(3-pyridinylmethyl)-, hydrochloride(2-aminophenyl)-N-(3-pyridylmethyl)carboxamideCDS1_000078Maybridge1_002366
Show more names
MFCD13194056OTAVA-BB 1133349CHEMBRDG-BB 9071355UKRORGSYN-BB BBR-030330Benzamide, 2-amino-N-(3-pyridinylmethyl)-2-amino-N-(pyridin-3-ylmethyl)benzamide hydrochloride2-amino-N-(3-pyridinylmethyl)benzamide(SALTDATA: HCl)
Oprea1_049923DivK1c_001118orb3144495SCHEMBL1399530HMS548D12DTXSID60384398VQCAHUSKECKWPX-UHFFFAOYSA-NALBB-025539
Database identifiers
- CAS
1214-48-8
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 68 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 257
Physicochemical properties
- storage temp.
- 2 · 2-8°C, protect from light
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 332 · H332-H335-H312-H319-H315-H302
- Precautionary statements
- 280 · P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501
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, 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%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H332-H335-H312-H319-H315-H302
- Precautionary statements
- P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers11 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
韶关市启程生物科技有限公司18122215013 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
上海珂臻医药科技有限公司021-021-021-31663258 13795219287 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
2 records
Compound notes
Loading…