Basic information
- CAS
91-38-3- Standard SMILES
COc1ccc(Nc2cc(Cl)ccc2C(=O)O)cc1- InChIKey
KAERBVZTGPZZHW-UHFFFAOYSA-N- Molecular formula
- C14H12ClNO3
- Average molar mass
- 277.7 g/mol
- Monoisotopic mass
- 277.05057092
Names & identifiers
- Preferred name
- 4-Chloro-2-((4-methoxyphenyl)amino)benzoic acid
- IUPAC
- 4-chloro-2-(4-methoxyanilino)benzoic acid
- English name
- 4-Chloro-2-(4-methoxy-phenylamino)-benzoic acid
- Molecular formula
- C14H12ClNO3
- Molecular weight
- 277.7
Names & synonyms
91-38-34-Chloro-2-((4-methoxyphenyl)amino)benzoic acidAnthranilic acid, 4-chloro-N-(p-methoxyphenyl)-4-Chloro-N-(p-methoxyphenyl)anthranilic acid4RP3BXZ88A4-Chloro-2-(4-methoxyphenyl)anthranilic acidBenzoic acid, 4-chloro-2-((4-methoxyphenyl)amino)-NSC-411504-CHLORO-2-[(4-METHOXYPHENYL)AMINO]BENZOIC ACIDDTXSID10238352Benzoic acid, 4-chloro-2-[(4-methoxyphenyl)amino]-RefChem:1070471
Show more names
4-Chloro-2-[(4-methoxyphenyl)amino2-(4-Methoxyanilino)-4-chlorobenzoic acid4-CHLORO-N-(4-METHOXYPHENYL)ANTHRANILIC ACID4-Chloro-2-(4-methoxy-phenylamino)-benzoic acid
DTXCID30160843202-065-24-chloro-2-(4-methoxyanilino)benzoic acidKUC105914NKSC-6-284MFCD00093990EINECS 202-065-2NSC 41150
Database identifiers
- CAS
91-38-3- PubChem CID
- 66674
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 305
Experimental & physicochemical properties
LogP4.41
Physicochemical properties
- Density
- 1.2527 · 1.2527 (rough estimate)
- refractive index
- 1.647 · 1.6470 (estimate)
- FDA UNII
- 4 RP3BXZ88A · 4RP3BXZ88A
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers10 total
杭州辅润医药科技有限公司15658004993 · [email protected]
杭州六可生物科技有限公司+86-0571-86912261 +86-15658003402 · [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]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
围场满族蒙古族自治县元合生物技术研发有限公司0314-7886310 18830416512 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
苏州晶锂格科技有限公司18551175068 · [email protected]
Related reactions
6 records
Compound notes
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