2-(propan-2-ylamino)benzoic acid

Modify Date: 2025-09-18 17:21:29

2-(propan-2-ylamino)benzoic acid Structure
2-(propan-2-ylamino)benzoic acid structure
Common Name 2-(propan-2-ylamino)benzoic acid
CAS Number 50817-45-3 Molecular Weight 179.21600
Density 1.158g/cm3 Boiling Point 326.567ºC at 760 mmHg
Molecular Formula C10H13NO2 Melting Point N/A
MSDS N/A Flash Point 151.303ºC

 Names

Name 2-(propan-2-ylamino)benzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.158g/cm3
Boiling Point 326.567ºC at 760 mmHg
Molecular Formula C10H13NO2
Molecular Weight 179.21600
Flash Point 151.303ºC
Exact Mass 179.09500
PSA 49.33000
LogP 2.27810
Index of Refraction 1.587
InChIKey OURMOWNIJUVJSE-UHFFFAOYSA-N
SMILES CC(C)Nc1ccccc1C(=O)O

 Safety Information

HS Code 2922499990

 Synthetic Route

~%

2-(propan-2-ylamino)benzoic acid Structure

2-(propan-2-yla...

CAS#:50817-45-3

Literature: Sandoz Pharm. Corp. Patent: US4670600 A1, 1987 ;

~76%

2-(propan-2-ylamino)benzoic acid Structure

2-(propan-2-yla...

CAS#:50817-45-3

Literature: Pellon, Rolando F.; Estevez-Braun, Ana; Docampo, Maite L.; Martin, Ana; Ravelo, Angel G. Synlett, 2005 , # 10 art. no. S01005ST, p. 1606 - 1608

~29%

2-(propan-2-ylamino)benzoic acid Structure

2-(propan-2-yla...

CAS#:50817-45-3

Literature: Ozaki; Yamada; Oine; Ishizuka; Iwasawa Journal of Medicinal Chemistry, 1985 , vol. 28, # 5 p. 568 - 576

~49%

2-(propan-2-ylamino)benzoic acid Structure

2-(propan-2-yla...

CAS#:50817-45-3

Literature: Ozaki; Yamada; Oine; Ishizuka; Iwasawa Journal of Medicinal Chemistry, 1985 , vol. 28, # 5 p. 568 - 576

 Customs

HS Code 2922499990
Summary HS:2922499990 other amino-acids, other than those containing more than one kind of oxygen function, and their esters; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0%

 Synonyms

N-isopropylanthranilic acid
N-Isopropyl-anthranilsaeure
acide isopropylamino-2 benzoique
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