Basic information
- CAS
34654-20-1- Standard SMILES
CC(C)Nc1ccncc1N- InChIKey
GWZGKUKHGGUWGK-UHFFFAOYSA-N- Molecular formula
- C8H13N3
- Average molar mass
- 151.21 g/mol
- Monoisotopic mass
- 151.11094743
Names & identifiers
- Preferred name
- N4-(1-Methylethyl)-3,4-pyridinediamine
- IUPAC
- 4-N-propan-2-ylpyridine-3,4-diamine
- English name
- 4-N-propan-2-ylpyridine-3,4-diamine
- Molecular formula
- C8H13N3
- Molecular weight
- 151.21
Names & synonyms
34654-20-14-N-(Propan-2-yl)pyridine-3,4-diamineN4-(1-Methylethyl)-3,4-pyridinediamineDTXSID101282214RefChem:831586DTXCID301712649845-005-6N4-(propan-2-yl)pyridine-3,4-diamine3,4-Pyridinediamine, N4-(1-methylethyl)-4-N-propan-2-ylpyridine-3,4-diamineN4-Isopropylpyridine-3,4-diamineN~4~-(propan-2-yl)pyridine-3,4-diamine
Show more names
(3-amino(4-pyridyl))(methylethyl)amineSCHEMBL16884493SCHEMBL293766533-amino-4-isopropylaminopyridineJBA65420SBB079445STL337442AKOS009237916
Database identifiers
- CAS
34654-20-1- PubChem CID
- 950989
- DTXSID
DTXSID101282214- EC Number
- 845-005-6
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 50.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 114
Physicochemical properties
- Boiling point
- 315.9 · 315.9±27.0 °C(Predicted)
- Density
- 1.097 · 1.097±0.06 g/cm3(Predicted)
- pka
- 9.12 · 9.12±0.36(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 335 · H335-H312-H332-H318-H302-H315
- Precautionary statements
- 261 · P261-P271-P304+P340-P312-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P280-P305+P351+P338-P310-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)
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
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H335-H312-H332-H318-H302-H315
- Precautionary statements
- P261-P271-P304+P340-P312-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
上海基玉医药科技有限公司02161739128 13816953660 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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