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CAS Number: 99-27-4
dimethyl 5-aminoisophthalate

Structure

dimethyl 5-aminoisophthalate
Name: dimethyl 5-aminoisophthalate
Synonyms:
General Information
Product Number: 99274

CAS Registry Number 99-27-4
Name:
1,​3-​Benzenedicarboxylic acid, 5-​amino-​, 1,​3-​dimethyl ester
1,3-Benzenedicarboxylic acid, 5-amino-, dimethyl ester (9CI)
Isophthalic acid, 5-amino-, dimethyl ester (7CI,8CI)
3,5-Bis(methoxycarbonyl)aniline
3,5-Dicarbomethoxyaniline
3,5-Dimethoxycarbonylaniline

 

Chemical Formula: C10H11NO4
Exact Mass: 209.07
Molecular Weight: 209.20
m/z: 209.07 (100.0%), 210.07 (11.3%)

 

InChI:InChI=1S/C10H11NO4/c1-14-9(12)6-3-7(10(13)15-2)5-8(11)4-6/h3-5H,11H2,1-2H3

InChI Key:DEKPYXUDJRABNK-UHFFFAOYSA-N

Canonical SMILES:COC(=O)C1=CC(=CC(=C1)N)C(=O)OC

 

Thermal Properties Value Condition Note
Boiling Point 178-180 °C   (1)CAS
Melting Point 180-181 °C   (6)CAS
Melting Point 178-180 °C   (7)CAS
Melting Point 176-178 °C   (8)CAS

Specification

98%

References
  1. (1) BE 603747 1961 CAPLUS
  2. (6) Zhandarev, V. V.; Izvestiya Vysshikh Uchebnykh Zavedenii, Khimiya i Khimicheskaya Tekhnologiya 2003, V46(3), P30-32 CAPLUS
  3. (7) Loria, Anthony; GB 977554 1964 CAPLUS
  4. (8) GB 695164 1953 CAPLUS
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