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L-Alanine 2-naphthylamide

HCID 688372
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3513-56-2
Standard SMILES
C[C@H](N)C(=O)Nc1ccc2ccccc2c1
InChIKey
RQHPADKWNYTHOH-VIFPVBQESA-N
Molecular formula
C13H14N2O
Average molar mass
214.26 g/mol
Monoisotopic mass
214.11061307

Overview

L-alanine 2-naphthylamide is an L-alanine derivative that is the amide obtained by formal condensation of the carboxy group of L-alanine with the amino group of 2-naphthylamine. It has a role as a chromogenic compound. It is an amino acid amide, a L-alanine derivative and a N-(2-naphthyl)carboxamide.

Names & identifiers

Preferred name
L-Alanine 2-naphthylamide
IUPAC
(2S)-2-amino-N-naphthalen-2-ylpropanamide
English name
H-Ala-betana HBr
Molecular formula
C13H15BrN2O
Molecular weight
295.17

Names & synonyms

720-82-1L-Alanine 2-naphthylamideH-ALA-BETANAL-alanine-2-naphthylamideL-Alanine beta-naphthylamide(S)-2-Amino-N-(2-naphthyl)propionamideH-Ala-NA(2S)-2-amino-N-naphthalen-2-ylpropanamideN-naphthalen-2-yl-L-alaninamideMFCD000649693513-56-2(S)-2-Amino-N-(naphthalen-2-yl)propanamide
Show more names
H-Ala-bNA·HBrH-Ala-βNA · HBrALANINE-BETANA HBRH-Ala-Betana HydrobromideL-Alanine2-naphthylamidehydrobromide2-amino-N-(2-naphthalenyl)propanamideL-alanine-B-naphthylamide hydrobromideL-Alanine-?-naphthylamide hydrobromide
(2S)-2-amino-N-(naphthalen-2-yl)propanamideH-Ala-betana hbrL-Alanine-b-naphthylamideH-Ala-bNAALANINE-BETANAH-Ala-NA HBralanine-2-naphthylamideH-L-Ala-2-naphthylamide

Database identifiers

CAS
3513-56-2、720-82-1

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
55.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
254

Physicochemical properties

storage temp.
20 °C · −20°C
Symbol(GHS)
8 · GHS08
Signal word
Warning
Hazard statements
351 · H351
Precautionary statements
201 · P201-P202-P281-P308+P313-P405-P501
Hazard Codes
Xn
Risk Statements
40 · 40
Safety Statements
22 · 22-36
WGK Germany
3 · 3

Safety & regulation

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

GHS classification

GHS Classification · 6 items

Warning

H351 (97.4%): Suspected of causing cancer [Warning Carcinogenicity]

P203, P280, P318, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory.

Danger

H350 (100%): May cause cancer [Danger Carcinogenicity]

Hazard information

Hazard Classes and Categories · 2 items

Carc. 1A (100%)

Carc. 2 (97.4%)

Safety data

wgk
3
risk_code
40
Signal word
Warning
Symbol(GHS)
GHS08
hazard_code
Xn
safety_code
22-36
Hazard statements
H351
Precautionary statements
P201-P202-P281-P308+P313-P405-P501

Chemistry & industry

Suppliers8 total

梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
宝鸡缔都医药化工有限公司029-029-81148929 17792602132 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
PubChem CID
688372
DTXSID
DTXSID901313920
ChEBI
CHEBI:90349
EC Number
211-956-5、636-868-8
Nikkaji
J193.093A