TCF

3-(4-BROMOPHENYL)PROPANAMIDE

Created:	2010-03-31
Last modified:	2021-03-01

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2 entries where TCF is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	0
Bond Count	22
Aromatic Bond Count	6

2D diagram of TCF

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Chemical Component Summary
Name	3-(4-BROMOPHENYL)PROPANAMIDE
Synonyms	PARA-BROMO-CIS-2-PHENYLCYCLOPROPYL-1-AMINE
Systematic Name (OpenEye OEToolkits)	3-(4-bromophenyl)propanamide
Formula	C₉ H₁₀ Br N O
Molecular Weight	228.086
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	Brc1ccc(cc1)CCC(=O)N
SMILES	CACTVS	3.352	NC(=O)CCc1ccc(Br)cc1
SMILES	OpenEye OEToolkits	1.6.1	c1cc(ccc1CCC(=O)N)Br
Canonical SMILES	CACTVS	3.352	NC(=O)CCc1ccc(Br)cc1
Canonical SMILES	OpenEye OEToolkits	1.6.1	c1cc(ccc1CCC(=O)N)Br
InChI	InChI	1.03	InChI=1S/C9H10BrNO/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5H,3,6H2,(H2,11,12)
InChIKey	InChI	1.03	MSYVIHNLCVUBFM-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	12273139

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