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CAS Number: 6158-54-9
methyl 4-benzoylbenzoate

Structure

methyl 4-benzoylbenzoate
Name: methyl 4-benzoylbenzoate
Synonyms:
General Information
Product Number: 6158549

CAS Registry Number 6158-54-9
Name:
Benzoic acid, 4-?benzoyl-?, methyl ester
Benzoic acid, p-benzoyl-, methyl ester (7CI,8CI)
4-(Methoxycarbonyl)benzophenone
4-Methoxycarbonyldiphenyl ketone
Methyl 4-benzophenonecarboxylate
Methyl 4-benzoylbenzoate

 

Chemical Formula: C15H12O3
Exact Mass: 240.08
Molecular Weight: 240.25
m/z: 240.08 (100.0%), 241.08 (16.5%), 242.09 (1.3%)

 

InChI:InChI=1S/C15H12O3/c1-18-15(17)13-9-7-12(8-10-13)14(16)11-5-3-2-4-6-11/h2-10H,1H3

InChI Key:UPXFXAMIFNGJLD-UHFFFAOYSA-N

Canonical SMILES:COC(=O)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2

 

Thermal Properties Value Condition Note
Melting Point 111-115 °C Solv: water (7732-18-5) (12)CAS
Melting Point 109.5-110.5 °C   (13)CAS
Melting Point 109-110 °C   (14)CAS
Melting Point 108-109 °C   (5)CAS
Melting Point 108-109 °C   (7)CAS
Melting Point 107-108 °C   (15)CAS
Melting Point 103.0 °C   (4)CAS
Melting Point 69-70 °C   (11)CAS
Melting Point 65-67 °C   (3)CAS

Specification

98%

References
  1. (3) Karthikeyan, Jaganathan; Chemical Communications (Cambridge, United Kingdom) 2011, V47(37), P10461-10463 CAPLUS
  2. (4) Wong, Ying-Chieh; Organic Letters 2010, V12(8), P1736-1739 CAPLUS
  3. (5) Cai, Mingzhong; European Journal of Organic Chemistry 2009, (10), P1585-1591 CAPLUS
  4. (7) Zheng, Guomin; Chinese Journal of Chemistry 2009, V27(7), P1420-1426 CAPLUS
  5. (11) Jeon, Kyu Ok; Journal of Heterocyclic Chemistry 2003, V40(5), P763-771 CAPLUS
  6. (12) Wang, Junzuo; Polymer International 2005, V54(11), P1537-1542 CAPLUS
  7. (13) Corson, B. B.; Journal of Organic Chemistry 1954, V19, P17-26 CAPLUS
  8. (14) Qin, Weiwei; Journal of Organometallic Chemistry 2008, V693(17), P2949-2953 CAPLUS
  9. (15) Newman, Melvin S.; Journal of the American Chemical Society 1966, V88(4), P781-4 CAPLUS
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