Basic information
- CAS
4108-61-6- Standard SMILES
Nc1ccc2cc(-c3ccccc3)c(=O)oc2c1- InChIKey
IJCLOOKYCQWSJA-UHFFFAOYSA-N- Molecular formula
- C15H11NO2
- Average molar mass
- 237.25 g/mol
- Monoisotopic mass
- 237.07897859
Names & identifiers
- Preferred name
- 2H-1-Benzopyran-2-one, 7-amino-3-phenyl-
- IUPAC
- 7-amino-3-phenylchromen-2-one
- English name
- 7-amino-3-phenyl-2-benzopyrone
- Molecular formula
- C15H11NO2
- Molecular weight
- 237.25
Names & synonyms
4108-61-62H-1-Benzopyran-2-one, 7-amino-3-phenyl-EINECS 223-887-8DTXSID1063304RefChem:484159DTXCID90398607-Amino-3-phenylcoumarin7-Amino-3-phenyl-2H-chromen-2-one7-Amino-3-phenyl-2-benzopyrone7-amino-3-phenylchromen-2-one3-phenyl-7-aminocoumarin7-Amino-3-phenyl-2H-1-benzopyran-2-one
Show more names
Coumarin 107-Amino-3-phenyl-2H-chromen-2-one, 7-Amino-2-oxo-3-phenyl-2H-1-benzopyran
SCHEMBL9849467-amino-3-phenyl-chromen-2-oneVN4G7224S9MFCD00035741STK333853AKOS0054399697-Amino-3-phenyl-2H-chromen-2-one #PS-11083
Database identifiers
- CAS
4108-61-6- PubChem CID
- 77751
- DTXSID
DTXSID1063304- UNII
- VN4G7224S9
- EC Number
- 223-887-8
- Nikkaji
- J24.848G
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 358
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- storage temp.
- Store at Room Tem.
- form
- powder
- color
- Yellow
- FDA UNII
- 4 G7224S9 · VN4G7224S9
- EPA Substance Registry System
- 2 H-1-Benzopyran-2-one, · 2H-1-Benzopyran-2-one, 7-amino-3-phenyl- (4108-61-6)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P363-P403+P233-P405-P501
- TSCA
- TSCA listed
- HS Code
- 2932990090 · 2932990090
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
- tsca
- TSCA listed
- hs_code
- 2932990090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P363-P403+P233-P405-P501
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2H-1-Benzopyran-2-one, 7-amino-3-phenyl-: INACTIVE
Suppliers10 total
苏州凯达生物医药技术有限公司0512-65856968 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
北京六合宁远医药科技股份有限公司010-60400365-8001 15910885229 · [email protected]
南京艾比克斯生化科技有限公司025-87193546 18652950785 · [email protected]
南京熙朗化工产品有限公司18936048580 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
贵州禾锡生物科技有限公司18786102937 18786102937 · [email protected]
Related reactions
2 records
Compound notes
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