(bromomethylphenyl-4')-2 Benzonitrile

Property	Value
InChI2D key string chemrof:inchi2d_key_string	LFFIEVAMVPCZNA-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C14H10BrN/c15-9-11-5-7-12(8-6-11)14-4-2-1-3-13(14)10-16/h1-8H,9H2
IUPAC name chemrof:IUPAC_name	2-(4-Bromomethylphenyl)benzonitrile
Molecular formula chemrof:molecular_formula	C14H10BrN
Molecular mass chemrof:molecular_mass	272.145
Monoisotopic mass chemrof:monoisotopic_mass	270.999661
SMILES string chemrof:smiles_string	N#Cc1ccccc1-c1ccc(CBr)cc1

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=114772-54-2	enrich_references.consensus_cas_link

Flow	Context	Source	Unit	CFs
f78e515f-3314-41d4-b9bf-c94be90a02dd	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
14a2164d-d6fa-442d-86bc-8e6c21f10d1e	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
4080f653-d520-445b-aab8-4334ea9f8e88	Environmental → Air → Indoor	EF 3.1	kg	2
38947c9c-230c-40e0-97e7-b536de38cf65	Environmental → Air → Long-term	EF 3.1	kg	0
7db6b585-b23f-47a5-9f9d-543afbfcfd9c	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
9466f0be-cfbd-4731-8e4a-ce5a71a39447	Environmental → Air → Unknown	EF 3.1	kg	2
63f76610-1869-4744-b936-e281c18235d5	Environmental → Ground → Agricultural	EF 3.1	kg	2
4c2d55b2-2a49-4c72-8b7d-47a6251ae367	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
85ebe791-9d75-452c-b369-7ed547423c8e	Environmental → Ground → Unknown	EF 3.1	kg	2
a6fcc9c7-369c-465f-ac4a-d7e55f4bba9b	Environmental → Water → Long-term	EF 3.1	kg	0
41027bd1-a47c-4682-9f2a-538993320874	Environmental → Water → Ocean	EF 3.1	kg	2
45906425-b897-4f09-9ac9-acd9e597db46	Environmental → Water → Surface water	EF 3.1	kg	2
053b505d-3d08-4f2a-bb46-9194feab0db5	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (52 changes)

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Flow object JSON

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}

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(bromomethylphenyl-4')-2 Benzonitrile

Identity

Structure

Properties

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Elementary flows

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