Basic information
- CAS
85771-09-1- Standard SMILES
CC(C)NCC(C)(C)O- InChIKey
SYZDMLOUOSPLHO-UHFFFAOYSA-N- Molecular formula
- C7H17NO
- Average molar mass
- 131.22 g/mol
- Monoisotopic mass
- 131.13101417
Names & identifiers
- Preferred name
- 1-Isopropylamino-2-methyl-2-propanol
- IUPAC
- 2-methyl-1-(propan-2-ylamino)propan-2-ol
- English name
- MFCD00086567
- Molecular formula
- C7H17NO
- Molecular weight
- 131.22
Names & synonyms
85771-09-1NSC 1282431-ISOPROPYLAMINO-2-METHYL-2-PROPANOLJ1JKGKA063UNII-J1JKGKA063NSC-128243DTXSID80235075N-isopropyl-N-(2,2-dimethyl-2-hydroxyethyl)amine2-PROPANOL, 1-ISOPROPYLAMINO-2-METHYL-2-propanol, 2-methyl-1-[(1-methylethyl)amino]-2-METHYL-1-((1-METHYLETHYL)AMINO)-2-PROPANOL2-PROPANOL, 2-METHYL-1-((1-METHYLETHYL)AMINO)-
Show more names
1-(isopropylamino)-2-methyl-propan-2-ol
RefChem:76131DTXCID80157566632-925-62-methyl-1-(propan-2-ylamino)propan-2-ol2-methyl-1-[(propan-2-yl)amino]propan-2-ol1-(Isopropylamino)-2-methylpropan-2-olMFCD000865671-(Isopropylamino)-2-methyl-2-propanol
Database identifiers
- CAS
85771-09-1- PubChem CID
- 97503
- DTXSID
DTXSID80235075- UNII
- J1JKGKA063
- EC Number
- 632-925-6
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 79
Physicochemical properties
- Boiling point
- 158 · 158-160 °C
- Density
- 0.8528 g/cm3 · 0.8528 g/cm3(Temp: 19 °C)
- pka
- 14.93 · 14.93±0.29(Predicted)
- FDA UNII
- 1 JKGKA063 · J1JKGKA063
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 335 · H335-H302-H318-H315
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362-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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H335-H302-H318-H315
- Precautionary statements
- P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Chemistry & industry
Applications
Uses1-Isopropylamino-2-methyl-2-propanol is a reagent used in organic synthesis. Used in the synthesis of progesterone receptor binding ligands.
Upstream & downstream products
Upstream raw materials
Suppliers6 total
广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
武汉永利源医药科技有限公司15927337358 · [email protected]
佰美济华（河南）医药科技有限公司0371-88900765 18037465274 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
7 records
Compound notes
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