4,5-Dihydro-1H-imidazol-2-ylmethanamine

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Basic information

CAS: 73706-73-7
Standard SMILES: NCC1=NCCN1
InChIKey: LDRSQURIJAHKPI-UHFFFAOYSA-N
Molecular formula: C4H9N3
Average molar mass: 99.13 g/mol
Monoisotopic mass: 99.0796473

Overview

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Names & identifiers

Preferred name: 4,5-Dihydro-1H-imidazol-2-ylmethanamine
IUPAC: 4,5-dihydro-1H-imidazol-2-ylmethanamine

Names & synonyms

4,5-Dihydro-1H-imidazol-2-ylmethanamine73706-73-74,5-Dihydro-1H-imidazol-2-ylmethylamine98019-24-0(4,5-dihydro-1H-imidazol-2-yl)methanamineNSC 194296NSC1942964,5-dihydro-1H-imidazol-2-ylmethanamine dihydrochlorideSCHEMBL906626SCHEMBL6422719DTXSID902240112-Imidazoline, 2-(aminomethyl)-

Show more names

YCA70673AKOS00634116498EG32748Z1H-Imidazole-2-methanamine, 4,5-dihydro-1-(4,5-Dihydro-1H-imidazol-2-yl)methanamineEN300-341944

Database identifiers

CAS: 73706-73-7、98019-24-0
PubChem CID: 426583
DTXSID: DTXSID90224011
UNII: 98EG32748Z

Properties

Computed structural properties

XLogP: -1.7
Topological polar surface area: 50.4 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 7
Formal charge: 0
Complexity: 86.9

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Compound notes

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