N-(4-Aminobenzoyl)-L-glutamic acid

HCID 196473CAS 4271-30-1

기본 정보

표준 SMILES
Nc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1
InChIKey
GADGMZDHLQLZRI-VIFPVBQESA-N
분자식
C12H14N2O5
평균 분자량
266.25 g/mol
단동위원소 질량
266.09027155

이름 및 식별자

우선 이름
N-(4-Aminobenzoyl)-L-glutamic acid
IUPAC
(2S)-2-[(4-aminobenzoyl)amino]pentanedioic acid

이름 및 동의어

N-(4-Aminobenzoyl)-L-glutamic acid4271-30-1N-(p-Aminobenzoyl)glutamic acidp-Aminobenzoyl-L-glutamic acidp-Aminobenzoylglutamic acid4-Aminobenzoylglutamic acidL-N-(p-Aminobenzoyl)glutamic acidL-Glutamic acid, N-(4-aminobenzoyl)-9BKY99A8HJCHEBI:61114DTXSID10873641NSC-71042
이름 더 보기
PABGARefChem:162076glutamyl-p-aminobenzoic acidpara-aminobenzoylglutamic acidDTXCID80149845224-261-7(S)-2-(4-Aminobenzamido)pentanedioic acidMFCD00042821

데이터베이스 식별자

CAS
4271-30-1
PubChem CID
196473
DTXSID
DTXSID10873641
ChEMBL
CHEMBL3278332
ChEBI
CHEBI:61114
UNII
9BKY99A8HJ
EC Number
224-261-7
Nikkaji
J15.173D

물성

구조 계산 물성

XLogP
0
극성 표면적
130 Ų
수소 결합 공여자 수
4
수소 결합 수용자 수
6
회전 가능 결합 수
6
무거운 원자 수
19

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (33.3%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H334 (33.3%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory];H335 (33.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory InformationN-(4-Aminobenzoyl)-L-glutamic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesSkin Sens. 1 (33.3%);Resp. Sens. 1 (33.3%)

규제 정보

Regulatory InformationN-(4-Aminobenzoyl)-L-glutamic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

관련 반응

1건

연결된 노트

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