Basic information
- CAS
114484-31-0- Standard SMILES
Nc1ccc(CO)cc1O- InChIKey
UQFATYJIZMAOEN-UHFFFAOYSA-N- Molecular formula
- C7H9NO2
- Average molar mass
- 139.15 g/mol
- Monoisotopic mass
- 139.06332853
Names & identifiers
- Preferred name
- 2-Amino-5-(hydroxymethyl)phenol
- IUPAC
- 2-amino-5-(hydroxymethyl)phenol
- English name
- Benzenemethanol, 4-amino-3-hydroxy-
- Molecular formula
- C7H9NO2
- Molecular weight
- 139.15
Names & synonyms
2-Amino-5-(hydroxymethyl)phenol114484-31-0DTXSID80561240RefChem:255649DTXCID60512018844-123-5Benzenemethanol, 4-amino-3-hydroxy-2-amino-5-hydroxymethyl-phenolSCHEMBL2342680UQFATYJIZMAOEN-UHFFFAOYSA-NPEA48431AKOS006350320
Show more names
SB85292BS-19308DB-182002CS-0370533EN300-747172G41822F758827
Database identifiers
- CAS
114484-31-0- PubChem CID
- 14520115
- DTXSID
DTXSID80561240- EC Number
- 844-123-5
- Nikkaji
- J2.374.985H
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 108
Physicochemical properties
- Boiling point
- 333.6 · 333.6±32.0 °C(Predicted)
- Density
- 1.338 · 1.338±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light, stored under nitrogen
- pka
- 9.53 · 9.53±0.10(Predicted)
- Appearance
- Light brown to brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Safety & regulation
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, 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
- H302-H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers8 total
阳谷荣科商贸有限公司15863541132 · [email protected]
菏泽星达医药科技有限公司13583079096 · [email protected]
上海安米克化学品有限公司微信：17321281695 18019252918
上海雷祺生物科技有限公司18621609968 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
山东煜昌药业有限公司531-87153728 13805401165 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
1 records
Compound notes
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