Basic information
- CAS
125767-32-0- Standard SMILES
NCCCNc1ncccn1- InChIKey
FHYDQGOVTLQZSZ-UHFFFAOYSA-N- Molecular formula
- C7H12N4
- Average molar mass
- 152.2 g/mol
Names & identifiers
- Preferred name
- N-(3-aminopropyl)pyrimidin-2-amine
- IUPAC
- N'-pyrimidin-2-ylpropane-1,3-diamine
Names & synonyms
N-(3-aminopropyl)pyrimidin-2-amine125767-32-0RefChem:826196858-546-8N1-(pyrimidin-2-yl)propane-1,3-diamineN'-pyrimidin-2-ylpropane-1,3-diamineSCHEMBL5596514SCHEMBL68653082-(3-aminopropylamino)pyrimidine2-(3-aninopropylamino)pyrimidineFHYDQGOVTLQZSZ-UHFFFAOYSA-NN-2-pyrimidinyl-1,3-propanediamine
Show more names
AKOS000186944N-(2-pyrimidinyl)propane-1,3-diamineEN300-58171G58979AB00999652-01
Database identifiers
- CAS
125767-32-0- PubChem CID
- 14397405
- EC Number
- 858-546-8
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 63.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 90.4
Safety & regulation
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 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%)
Related reactions
27 records
Compound notes
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