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Benzoyltyrosine 4-nitroanilide

HCID 188992
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
6154-45-6
Standard SMILES
O=C(N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1
InChIKey
CJERUMAUMMIPRF-FQEVSTJZSA-N
Molecular formula
C22H19N3O5
Average molar mass
405.4 g/mol
Monoisotopic mass
405.13247072

Overview

RN given refers to (L)-isomer

Names & identifiers

Preferred name
Benzoyltyrosine 4-nitroanilide
IUPAC
N-[(2S)-3-(4-hydroxyphenyl)-1-(4-nitroanilino)-1-oxopropan-2-yl]benzamide
English name
BZ-TYR-PNA
Molecular formula
C22H19N3O5
Molecular weight
405.4

Names & synonyms

6154-45-6BTPNABenzoyltyrosine 4-nitroanilideBenzoyl-L-tyrosine p-nitroanilide(S)-alpha-(Benzoylamino)-4-hydroxy-N-(4-nitrophenyl)benzenepropanamideRefChem:916982BZ-TYR-PNAN-Benzoyl-l-tyrosine p-nitroanilide(S)-N-(3-(4-Hydroxyphenyl)-1-((4-nitrophenyl)amino)-1-oxopropan-2-yl)benzamideMFCD00038109N-[(2S)-3-(4-hydroxyphenyl)-1-(4-nitroanilino)-1-oxopropan-2-yl]benzamideL-BTpNA
Show more names
BZO-TYR-PNABz-L-Tyr-pNABZ-TYROSINE-PNABENZOYL-L-TYROSINE 4-NITROANILIDE
SCHEMBL1351202DTXSID60977108AS-87589DA-61968HY-134445CS-0142416G77529F569223

Database identifiers

CAS
6154-45-6
PubChem CID
188992
DTXSID
DTXSID60977108

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
124 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
30
Formal charge
0
Complexity
586

Physicochemical properties

Melting point
235 · 235-237 °C
Boiling point
776.8 · 776.8±60.0 °C(Predicted)
Density
1.373 · 1.373±0.06 g/cm3(Predicted)
storage temp.
-20 °C · -20°C
pka
9.87 · 9.87±0.15(Predicted)
form
powder
color
white
InChI
1S/C22H19N3O5/c26-19-12-6-15(7-13-19)14-20(24-21(27)16-4-2-1-3-5-16)22(28)23-17-8-10-18(11-9-17)25(29)30/h1-13,20,26H,14H2,(H,23,28)(H,24,27)
InChIKey
CJERUMAUMMIPRF-UHFFFAOYSA-N
SMILES
Oc1ccc(CC(NC(=O)c2ccccc2)C(=O)Nc3ccc(cc3)[N+]([O-])=O)cc1
UNSPSC Code
12352209 · 12352209
NACRES
26 · NA.26
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
Signal word
Warning
Symbol(GHS)
GHS07
Storage Class
11 - Combustible Solids
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Applications

UsesN-Benzoyl-L-tyrosine p-nitroanilide (BTPNA) is used as a substrate to identify, differentiate and characterize serine carboxypeptidase(s) and various proteases.

Suppliers35 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海优宁维生物科技股份有限公司15921930842 15921930842 · [email protected]
南京昱盛康生物科技有限公司13327808530 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
Syntechem Co.,Ltd[email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
杭州思诺达医药科技有限责任公司0571-87213919 17306812703 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
常州希辰曦生物科技有限公司13961235446 · [email protected]
LEON (NANJING) BIOTECHNOLOGY CO., LTD.15051830413 · [email protected]
Shanghai Hanhong Scientific Co., Ltd.

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Nikkaji
J1.423.955C
261 · P261-P305+P351+P338
PPE
95 · Eyeshields, Gloves, type N95 (US)
WGK Germany
3 · 3
Storage Class
11 · 11 - Combustible Solids
+undefined17612118332 · [email protected]
杭州专肽生物技术有限公司17342063383 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
杭州贝普泰生物医药有限公司0571-85350119 13305819357 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海珈得尔化学技术有限公司13564435016 13564435016 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
四川普西奥标物科技有限公司13540909846 13882008651 · [email protected]
南京莱昂生物科技有限公司025-84523390 -127; 17705183659 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
南京肽业生物科技有限公司025-58361106-805 15951641583 · [email protected]
杭州肽佳生物科技有限公司0571-87213919 15967184799 · [email protected]
上海皑博生物科技有限公司+86-21-37621270 · [email protected]
Aladdin Scientific[email protected]
吉尔生化(上海)有限公司21-61263452 13641803416 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
南昌探真生物技术有限公司13758194781 13173652190 · [email protected]
上海鼓臣生物技术有限公司021-34675735 19147740836 · [email protected]
DONBOO AMINO ACID COMPANY13063595538 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
浙江昂拓莱司生物技术有限公司0571-88760729 18072970094 · [email protected]