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2-chloro-N-phenylpropanamide

HCID 264646
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
21262-52-2
Standard SMILES
CC(Cl)C(=O)Nc1ccccc1
InChIKey
BWWXKHHVIAJJFM-UHFFFAOYSA-N
Molecular formula
C9H10ClNO
Average molar mass
183.63 g/mol
Monoisotopic mass
183.0450916

Names & identifiers

Preferred name
2-chloro-N-phenylpropanamide
IUPAC
2-chloro-N-phenylpropanamide
English name
2'-CHLOROPROPIONANILIDE
Molecular formula
C9H10ClNO
Molecular weight
183.64

Names & synonyms

2-chloro-N-phenylpropanamideDTXSID10295127Propanamide, 2-chloro-N-phenyl-RefChem:86432DTXCID60246265800-229-3BWWXKHHVIAJJFM-UHFFFAOYSA-N21262-52-22'-chloropropionanilideMFCD039885332-chloro-N-phenylpropionamideNSC99819
Show more names
T0517-58482-chloro-N-phenylpropanamide(SALTDATA: FREE)Prilocaine impurity 12/2-Chloro-N-phenylpropanamide
2-Chloro-N-phenyl-propionamideN-phenyl-2-chloropropanamideN-Phenyl-2-chloropropionamidePropanamide,2-chloro-N-phenyl-Prilocaine-005N-Phenyl-2-chloro-2-methylacetamidePrilocaine Impurity 8N-(2-Chloropropionyl)aniline

Database identifiers

CAS
21262-52-2
PubChem CID
264646
DTXSID
DTXSID10295127
EC Number
800-229-3
Nikkaji
J29.479I

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
12
Formal charge
0
Complexity
155

Physicochemical properties

Melting point
91 · 91-93 °C
Boiling point
89 · 89-90 °C(Press: 4 Torr)
Density
1.218 · 1.218±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
storage temp.
2 · Storage temp. 2-8°C
pka
13.145 · 13.145±0.70(predicted)
Appearance
Light yellow to yellow Solid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
332 · H332-H315-H319-H302-H312-H335
Precautionary statements
264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P
HS Code
2924297099 · 2924297099

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Warning

H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (66.7%)

Safety data

hs_code
2924297099
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H332-H315-H319-H302-H312-H335
Precautionary statements
P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P302+P352-P312-P322-P363-P501-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P

Chemistry & industry

Suppliers31 total

济南百隆化学有限公司[email protected] · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
希瓦生物科技(广州)有限公司13268215580 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
上海裕兰生物科技有限公司021-57171705 13817537615 · [email protected]
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
深圳卓越生物医药科技有限公司26050679 18318671572 · [email protected]
Standardpharm Co. Ltd.86-714-3992388 · [email protected]
湖北扬信医药科技有限公司07143299675 13092790750 · [email protected]

Related reactions

2 records
New reaction record
HRID 1572981 reaction equation
HRID 1572981As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 2308735 reaction equation
HRID 2308735As productuspto-grants-1987_09

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
上海源叶生物科技有限公司18916372613 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
深圳菲斯生物科技有限公司0755-4000505016 13380397412 · [email protected]
武汉研哲科技有限公司15527250409 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
山东诚创蓝海医药科技有限公司0531-58897130 15508676053 · [email protected]
深圳博泰尔生物技术有限公司13316949107 13316968096 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
四川嘉瑛莱科技有限责任公司028-64159575 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
JACS-郑州杰克斯化工产品有限公司0371-86259281 13223061139 · [email protected]
广州市震霖医药科技有限公司020-18102736 13622807357 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]