2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonic acid

Modify Date: 2025-08-26 20:25:09

2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonic acid Structure
2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonic acid structure
Common Name 2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonic acid
CAS Number 85391-99-7 Molecular Weight 396.39300
Density 1.412g/cm3 Boiling Point 738.7ºC at 760 mmHg
Molecular Formula C21H20N2O6 Melting Point N/A
MSDS N/A Flash Point 400.5ºC

 Names

Name 2-acetamido-2-[(5-phenylmethoxy-1H-indol-3-yl)methyl]propanedioic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.412g/cm3
Boiling Point 738.7ºC at 760 mmHg
Molecular Formula C21H20N2O6
Molecular Weight 396.39300
Flash Point 400.5ºC
Exact Mass 396.13200
PSA 132.21000
LogP 3.17380
Index of Refraction 1.667
InChIKey NVXJPXIZOAASQU-UHFFFAOYSA-N
SMILES CC(=O)NC(Cc1c[nH]c2ccc(OCc3ccccc3)cc12)(C(=O)O)C(=O)O

 Safety Information

HS Code 2933990090

 Synthetic Route

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2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonic acid Structure

2-acetamido-2-(...

CAS#:85391-99-7

Literature: Koo et al. Journal of Organic Chemistry, 1959 , vol. 24, p. 179,183

~%

2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonic acid Structure

2-acetamido-2-(...

CAS#:85391-99-7

Literature: Koo et al. Journal of Organic Chemistry, 1959 , vol. 24, p. 179,183

~%

2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonic acid Structure

2-acetamido-2-(...

CAS#:85391-99-7

Literature: Koo et al. Journal of Organic Chemistry, 1959 , vol. 24, p. 179,183

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

acetylamino-(5-benzyloxy-indol-3-ylmethyl)-malonic acid
Propanedioic acid,(acetylamino)[[5-(phenylmethoxy)-1H-indol-3-yl]methyl]-(9CI)
Propanedioic acid,2-(acetylamino)-2-[[5-(phenylmethoxy)-1H-indol-3-yl]methyl]
EINECS 286-856-8
2-acetamido-2-{[5-(phenylmethoxy)indol-3-yl]methyl}malonic acid
Malonicacid,acetamido[[5-(benzyloxy)indol-3-yl]methyl]-(6CI)
Acetylamino-(5-benzyloxy-indol-3-ylmethyl)-malonsaeure
5-Benzyloxy-3-(2-acetamino-2,2-dicarboxy-ethyl)-indol
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