Vitas-M small molecule compound

1-(4-butoxy-3-chlorobenzyl)guanidine

Catalog ID
STK556304
SMILES CCCCOc1ccc(cc1Cl)CNC(=N)N

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H18ClN3O MW 255.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18ClN3O/c1-2-3-6-17-11-5-4-9(7-10(11)13)8-16-12(14)15/h4-5,7H,2-3,6,8H2,1H3,(H4,14,15,16)
InChIKey
NPRFQPBCXGRCCG-UHFFFAOYSA-N
Synonyms
49872-12-0
1(4butoxy3chlorobenzyl)guanidine
2((4BUTOXY3CHLOROPHENYL)METHYL)GUANIDINE
49872120
CCCCOC1=C(C=C(C=C1)CN=C(N)N)Cl
InChI=1SC12H18ClN3Oc12361711549(710(11)13)81612(14)15h457H2368H21H3(H4141516)
MFCD00440335
N(4BUTOXY3CHLOROBENZYL)GUANIDINE
ZINC000003159626
ZINC3159626

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.