Basic information
- CAS
2113-56-6- Standard SMILES
COc1cccc(-c2ccccc2)c1- InChIKey
KQMIWCAOEFUBQK-UHFFFAOYSA-N- Molecular formula
- C13H12O
- Average molar mass
- 184.23 g/mol
- Monoisotopic mass
- 184.088815
Names & identifiers
- Preferred name
- 3-Methoxybiphenyl
- IUPAC
- 1-methoxy-3-phenylbenzene
- English name
- 3-Methoxybiphenyl
- Molecular formula
- C13H12O
- Molecular weight
- 184.23
Names & synonyms
3-Methoxybiphenyl2113-56-61,1'-Biphenyl, 3-methoxy-Anisole, m-phenyl-DTXSID60292969RefChem:94637DTXCID10244110666-104-9KQMIWCAOEFUBQK-UHFFFAOYSA-N3-Methoxy-1,1'-biphenyl1-methoxy-3-phenylbenzenemethoxybiphenyl
Show more names
3-Methoxybiphenyl>3-METHOXYBIPHENYL 95+%
MFCD000275143-phenylanisole3-Methoxy-biphenyl3-methoxy biphenylNSC866033-methoxy-1,1-biphenyl1-methoxy-3-phenyl-benzeneSCHEMBL336435
Database identifiers
- CAS
2113-56-6- PubChem CID
- 257971
- DTXSID
DTXSID60292969- ChEMBL
CHEMBL3814155- EC Number
- 666-104-9
- Nikkaji
- J99.437E
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 161
Physicochemical properties
- Melting point
- 88 · 88-90 °C
- Boiling point
- 140 °C · 140 °C / 5mmHg
- Density
- 1.08 · 1.08
- refractive index
- 1.607 · 1.6070-1.6100
- storage temp.
- Store at room temperature
- form
- clear liquid
- color
- Colorless to Light yellow
- CAS DataBase Reference
- 2113 · 2113-56-6(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 302 · H302-H318-H315-H335
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362
- Safety Statements
- 24 · 24/25
- HS Code
- 29093090 · 29093090
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 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
- hs_code
- 29093090
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- safety_code
- 24/25
- Hazard statements
- H302-H318-H315-H335
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers34 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
Related reactions
14 records
Compound notes
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