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Structure

2-Amino-1-(4-methoxybenzyl)-4,5,6,7-tetrahydro-1H-indole-3-carbonitrile

CAS
113772-12-6
Catalog Number
ACM113772126
Category
Other Products
Molecular Weight
281.36
Molecular Formula
C17H19N3O

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Specification

Synonyms
Oprea1_077482, MolPort-003-355-401, ZINC00169549, CID2764069, 5T-0002, 113772-12-6
IUPAC Name
2-amino-1-[(4-methoxyphenyl)methyl]-4,5,6,7-tetrahydroindole-3-carbonitrile
Canonical SMILES
COC1=CC=C(C=C1)CN2C3=C(CCCC3)C(=C2N)C#N
InChI Key
HMITZZIOYJRWFM-UHFFFAOYSA-N
Boiling Point
516.8ºC at 760mmHg
Melting Point
130-132ºC
Flash Point
266.4ºC
Density
1.21g/cm³
Exact Mass
281.15300
H-Bond Acceptor
3
H-Bond Donor
1
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