Basic information
- CAS
50361-60-9- Standard SMILES
NCC1(O)CCCc2ccccc21- InChIKey
JPSHSGBMKXSDOR-UHFFFAOYSA-N- Molecular formula
- C11H15NO
- Average molar mass
- 177.24 g/mol
- Monoisotopic mass
- 177.1153641
Names & identifiers
- Preferred name
- 1-(Aminomethyl)-1,2,3,4-tetrahydronaphthalen-1-ol
- IUPAC
- 1-(aminomethyl)-3,4-dihydro-2H-naphthalen-1-ol
- English name
- 1-Aminomethyl-1,2,3,4-tetrahydro-naphthalen-1-ol
- Molecular formula
- C11H15NO
- Molecular weight
- 177.24
Names & synonyms
50361-60-91-(aminomethyl)-1,2,3,4-tetrahydronaphthalen-1-olDTXSID90512849RefChem:225996DTXCID00463656839-465-71-Aminomethyl-1,2,3,4-tetrahydro-naphthalen-1-ol1-(AMINOMETHYL)-3,4-DIHYDRO-2H-NAPHTHALEN-1-OLCHEMBL340151SCHEMBL1333907JPSHSGBMKXSDOR-UHFFFAOYSA-NACA36160
Show more names
AKOS BC-0264UKRORGSYN-BB BBV-1822131-Naphthalenol, 1-(aminomethyl)-1,2,3,4-tetrahydro-
MFCD02179235AKOS004123077AB11059DS-020448EN300-73172(1,2,3,4-tetrahydro-1-hydroxynaphthyl)methyamine(1-hydroxy-1,2,3,4-tetrahydronaphthyl)methylamine1-aminomethyl-1-hydroxy-1,2,3,4-tetrahydronaphthalene
Database identifiers
- CAS
50361-60-9- PubChem CID
- 12914859
- DTXSID
DTXSID90512849- ChEMBL
CHEMBL340151- EC Number
- 839-465-7
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H302-H315
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；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, 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%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H302-H315
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers5 total
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
上海药禾平生物医药科技有限公司57540919 13120888836 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
13 records
Compound notes
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