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1,4-Naphthalenedione, 2-bromo- (9CI)

HCID 74944
NotesReactions

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

Basic information

CAS
2065-37-4
Standard SMILES
O=C1C=C(Br)C(=O)c2ccccc21
InChIKey
KJOHPBJYGGFYBJ-UHFFFAOYSA-N
Molecular formula
C10H5BrO2
Average molar mass
237.052 g/mol
Monoisotopic mass
235.9472915

Names & identifiers

Preferred name
1,4-Naphthalenedione, 2-bromo- (9CI)
IUPAC
2-Bromonaphthalene-1,4-dione
English name
2-Bromo-1 4-naphthoquinone 98
Molecular formula
C10H5BrO2
Molecular weight
237.05

Names & synonyms

2-broMonaphthalene-1,4-dione3-Bromo-1,4-naphthoquinone2-Bromonaphthalne-1,4-dione1,4-Naphthalenedione,2-broMo-2-Bromo-1 4-naphthoquinone 982-Bromo-1,4-naphthoquinone 98%

Database identifiers

CAS
2065-37-4
PubChem CID
74944
DTXSID
DTXSID90174688
ChEMBL
CHEMBL349148
UNII
T3SMU54CXM
EC Number
628-013-2
Nikkaji
J151.329J

Properties

Physicochemical properties

Melting point
131 · 131-133 °C(lit.)
Boiling point
324.2 · 324.2±42.0 °C(Predicted)
Density
1.757 · 1.757±0.06 g/cm3(Predicted)
storage temp.
Inert atmosphere,Room Temperature
solubility
Chloroform (Slightly), Methanol (Slightly, Heated)
form
Solid
color
Yellow to Dark Yellow
InChI
1S/C10H5BrO2/c11-8-5-9(12)6-3-1-2-4-7(6)10(8)13/h1-5H
InChIKey
KJOHPBJYGGFYBJ-UHFFFAOYSA-N
SMILES
BrC1=CC(=O)c2ccccc2C1=O
FDA UNII
3 SMU54CXM · T3SMU54CXM
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs
Respiratory system
PPE
95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
WGK Germany
3 · 3
Storage Class
11 · 11 - Combustible Solids

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

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36
Storage Class
11 - Combustible Solids
target organs
Respiratory system
Hazard statements
H315-H319-H335
Hazard Classifications
Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements
P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Applications · 2 items

Uses2-Bromo-1,4-naphthoquinone may be used in the preparation of:benzo[f]indolequinones2-azido-1,4-naphthoquinone2-allyl-3-bromo-1,4-naphthoquinone2-(3-indolyl)-1,4-naphthoquinones

General Description2-Bromo-1,4-naphthoquinone (BrQ) is a 1,4-naphthoquinone derivative that can be prepared by the bromination of 1-naphthol using N-bromosuccinimide. Its efficacy as an antifeedant against the cabbage looper, Trichoplusia ni has been evaluated.2 The reaction of BrQ with xanthene under photochemical conditions has been investigated. A report suggests that the replacement of 2-methyl-1,4-naphthoquinone with BrQ enhances its ability to produce hydrogen peroxide which can be employed for cancer treatment.

Upstream & downstream products

Downstream products

(3-Bromo-1,4-dimethoxy-naphthalen-2-yl)-acetaldehyde

Suppliers45 total

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
Aladdin Scientific[email protected]

Related reactions

17 records
New reaction record
HRID 260755 reaction equation
HRID 260755As reactantuspto-grants-1996_06
HRID 260756 reaction equation
HRID 260756As productuspto-grants-1996_06
HRID 260757 reaction equation
HRID 260757As reactantuspto-grants-1996_06
HRID 260762 reaction equation
HRID 260762As reactantuspto-grants-1996_06
HRID 418864 reaction equation
HRID 418864As reactantuspto-grants-2012_01
HRID 483828 reaction equation
HRID 483828As reactantuspto-grants-1993_07
HRID 483829 reaction equation
HRID 483829As productuspto-grants-1993_07
HRID 483830 reaction equation
HRID 483830As reactantuspto-grants-1993_07
Page 1 of 3

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Hazard Classifications
2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
Syntechem Co.,Ltd
[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
南京精瑞久安生物技术有限公司025-58196018 800028039 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
北京奥秘佳得医药科技有限公司+86-13522808617 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
南京恰风和医药科技有限公司025-57018978 18251899859 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海谱振生物科技有限公司4001650900 13817534909 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
山东利腾生物科技有限公司15020019777 18663721413 · [email protected]
艾吉析科技(上海)有限公司17721401538;17717235263 17721401538 · [email protected]
南京科晟祥科技有限公司18252089365 · [email protected]
南京江恒医药化工有限公司13951936332 18305166317 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
南京博米尔生物科技有限公司025-83453382-8005 · [email protected]
上海特伯化学科技有限公司021-58170097 · [email protected]
武汉易谊化学科技有限公司0711-3617768 13308685235 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
Speranza Chemical Co., Ltd.+86-86-075521030354 +86-18688942810 · [email protected]
郑州艾克姆化工有限公司037163312495 13303845143 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
苏州沃尔森生物科技有限公司18934576691 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Shanxi Xuanran Import and Export Trade Co., Ltd.+8617735180244 · [email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
Coresyn Pharmatech Co., Ltd.+86-571-86626709 +86-18157142896 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Richest Group Ltd18017061086 · [email protected]
四川山冈生物医药科技有限公司13990000934,13076045191 13990000934 · [email protected]
武汉鑫晟阳生物科技有限公司18402740988 18402740988 · [email protected]
淄博航宇生物科技发展有限公司+86-0533-2185556 +86-15965530500 · [email protected]
河南威梯希化工科技有限公司0371-55135753 18003832934 · [email protected]