기본 정보
- 표준 SMILES
O=C([O-])c1ccc(O)cc1.[Na+]- InChIKey
ZLVSYODPTJZFMK-UHFFFAOYSA-M- 분자식
- C7H5NaO3
- 평균 분자량
- 160.1 g/mol
- 단동위원소 질량
- 160.0136383
이름 및 식별자
- 우선 이름
- Sodium 4-hydroxybenzoate
- IUPAC
- sodium 4-hydroxybenzoate
이름 및 동의어
Sodium 4-hydroxybenzoateSodium p-hydroxybenzoate4-Hydroxybenzoic acid sodium saltsodium parabenBenzoic acid, 4-hydroxy-, monosodium saltp-Hydroxybenzoic acid sodium saltMonosodium p-hydroxybenzoateMonosodium 4-hydroxybenzoateBenzoic acid, 4-hydroxy-, sodium salt (1:1)EINECS 204-051-1p-hydroxybenzoic acid monosodium saltV6102T509B
이름 더 보기
DTXSID3059426BENZOIC ACID, p-HYDROXY-, SODIUM SALTCHEBI:113449SODIUM 4-HYDROXYBENZOIC ACIDBENZOIC ACID, P-HYDROXY-, MONOSODIUM SALTRefChem:887100SODIUM PARABEN [INCI]DTXCID5033337
데이터베이스 식별자
- CAS
114-63-6- PubChem CID
- 16219477
- DTXSID
DTXSID3059426- ChEMBL
CHEMBL1762656- ChEBI
CHEBI:113449- UNII
- V6102T509B
- EC Number
- 204-051-1
물성
구조 계산 물성
- 극성 표면적
- 60.4 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 130
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 3.5% (3 of 86) of reports.
Warning
H315 (96.5%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (96.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (95.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 86 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 3 of 86 reports by companies.；There are 5 notifications provided by 83 of 86 reports by companies with hazard statement code(s).；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 InformationBenzoic acid, 4-hydroxy-, monosodium salt: 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 Irrit. 2 (96.5%)；Eye Irrit. 2 (96.5%)；STOT SE 3 (95.3%)
독성 정보
Toxicity Summary
The CIR Expert Panel concluded that the following 20 parabens are safe in cosmetics in the present practices of use and concentration described in the safety assessment when the sum of the combined concentration of parabens in any given formulation does not exceed 0.8 %...Sodium Paraben...
Safe for use in cosmetics, with qualifications
규제 정보
Regulatory InformationBenzoic acid, 4-hydroxy-, monosodium salt: 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.
화학 및 산업
용도 및 제조
UsesCIR ingredient: Sodium Paraben
Use ClassificationCosmetics -> Preservative
General Manufacturing InformationBenzoic acid, 4-hydroxy-, sodium salt (1:1): ACTIVE
관련 반응
4건
연결된 노트
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