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1-(3-Bromopropyl)-2-chlorobenzene

HCID 294115
NotesReactions

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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
54877-27-9
Standard SMILES
Clc1ccccc1CCCBr
InChIKey
AKMIGKNTCCSJNQ-UHFFFAOYSA-N
Molecular formula
C9H10BrCl
Average molar mass
233.53 g/mol
Monoisotopic mass
231.96544

Names & identifiers

Preferred name
1-(3-Bromopropyl)-2-chlorobenzene
IUPAC
1-(3-bromopropyl)-2-chlorobenzene
English name
1-(3-Bromopropyl)-2-chlorobenzene
Molecular formula
C9H10BrCl
Molecular weight
233.53

Names & synonyms

1-(3-bromopropyl)-2-chlorobenzene54877-27-9MFCD09744362NSC162079SCHEMBL6681501DTXSID50303795AKMIGKNTCCSJNQ-UHFFFAOYSA-N1-(3-bromopropyl)-2-chloro-benzene1-bromo-3-(2-chlorophenyl)-propaneAKOS011895271AB90582NSC-162079
Show more names
1-Chloro-2-(3-bromopropyl)benzeneBenzene, 1-(3-bromopropyl)-2-chloro-
BS-28586DA-04966C78298EN300-674596

Database identifiers

CAS
54877-27-9
PubChem CID
294115
DTXSID
DTXSID50303795

Properties

Computed structural propertiesFilling in

XLogP
3.9
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
3
Heavy atoms
11
Formal charge
0
Complexity
106

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Applications

Uses1-(3-Bromopropyl)-2-chlorobenzene is used in preparation of tetrazolinone compounds as pest control agents

Suppliers9 total

江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
上海马氏化学科技有限公司19916721580 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
上海修时生物医药有限公司15002184385 15021598081 15002184385 · [email protected]
上海新平精细化学品有限公司18221735425 · [email protected]
苏州诺行贸易有限公司0512-65816829 18662214788 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]

Related reactions

4 records
New reaction record
HRID 257482 reaction equation
HRID 257482As reactantuspto-grants-1993_11
HRID 428610 reaction equation
HRID 428610As reactantuspto-grants-2001_11
HRID 696681 reaction equation
HRID 696681As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1017740 reaction equation
HRID 1017740As reactantuspto-grants-2002_11

Compound notes

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