Basic information
- CAS
13169-71-6- Standard SMILES
O=C(c1ccc(Cl)cc1)c1ccc[nH]1- InChIKey
YTVORWPYOKKVAM-UHFFFAOYSA-N- Molecular formula
- C11H8ClNO
- Average molar mass
- 205.64 g/mol
- Monoisotopic mass
- 205.0294416
Names & identifiers
- Preferred name
- 4-Chlorophenyl 2-pyrrolyl ketone
- IUPAC
- (4-chlorophenyl)-(1H-pyrrol-2-yl)methanone
- English name
- (4-chlorophenyl)(1H-pyrrol-2-yl)methanone
- Molecular formula
- C11H8ClNO
- Molecular weight
- 205.64
Names & synonyms
13169-71-64-CHLOROPHENYL 2-PYRROLYL KETONERefChem:522019668-129-0(4-chlorophenyl)(1H-pyrrol-2-yl)methanonemethanone, (4-chlorophenyl)-1H-pyrrol-2-yl-(4-chlorophenyl)-(1H-pyrrol-2-yl)methanone(4-Chloro-phenyl)-(1H-pyrrol-2-yl)-methanoneMFCD000902582-p-chlorobenzoylpyrroleSCHEMBL6424225YTVORWPYOKKVAM-UHFFFAOYSA-N
Show more names
2-(p-Chlorobenzoyl)pyrrolePyrrol-2-yl 4-chlorophenyl ketone
4-chlorophenyl pyrrol-2-yl ketone2-(4-CHLOROBENZOYL)PYRROLESBB093545AKOS013059887AB03260AC-29473AS-77397(4-chlorophenyl)-1H-pyrrol-2-ylmethanone
Database identifiers
- CAS
13169-71-6- PubChem CID
- 640241
- EC Number
- 668-129-0
- Nikkaji
- J515.892C
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 32.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 211
Physicochemical properties
- storage temp.
- Sealed in dry,Room Temperature
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers18 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
南通敏言生物医药科技有限公司0513-85921823 18662920231 · [email protected]
北京建强伟业科技有限公司（FUSION弗珍试剂品牌）0531-88924771 15614660963 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
合肥瑞科昇生物科技有限公司0551-66336380 18956014586 · [email protected]
南京美韬医药科技有限公司[email protected] · [email protected]
Hefei Hirisun Pharmatech Co., Ltd
Related reactions
5 records
Compound notes
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