탄산,모노에틸에스테르,칼륨염

Carbonic Acid

HCID 767CAS 22719-67-1

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=C(O)O
InChIKey: BVKZGUZCCUSVTD-UHFFFAOYSA-N
분자식: CH2O3
평균 분자량: 62.025 g/mol
단동위원소 질량: 62.00039392

이름 및 식별자

우선 이름: Carbonic Acid
IUPAC: carbonic acid
현지명: 탄산,모노에틸에스테르,칼륨염
영어명: CARBONIC ACID, MONOETHYL ESTER, POTASSIUM SALT
분자식: C3H5KO3
분자량: 128.1683

이름 및 동의어

carbonic acid463-79-6Dihydrogen carbonateH2CO3DTXSID9043801CHEBI:28976Acid, CarbonicRefChem:6524DTXCID7023801610-295-3682-330-0hydroxy ketone

이름 더 보기

탄산,모노에틸에스테르,칼륨염Potassium ethyl carbonateCARBONIC ACID, MONOETHYL ESTER, POTASSIUM SALT

hydroxy-ketoneAcidosancomponent of Col-Evaccarbonicacidcomponent of PrettsdihydroxyketonehydroxyketoneKoehlensaeure

데이터베이스 식별자

CAS: 22719-67-1、463-79-6、71-52-3
PubChem CID: 767
DTXSID: DTXSID9043801
ChEBI: CHEBI:28976
EC Number: 610-295-3、682-330-0
Nikkaji: J148.096K

물성

구조 계산 물성

XLogP: -0.1
극성 표면적: 57.5 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 0
무거운 원자 수: 4
형식 전하: 0
복잡도: 26

실험 및 물리화학적 성질

Solubility12.8 mg/mL (cold water)

Melting Point720 °C

Physical DescriptionSolid

물리화학적 성질

밀도: 2.373 g/cm3 · 2.373 g/cm3

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Regulatory InformationCarbonic 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.

Hazards Summary · 1건

The hypothetical acid of carbon dioxide and water. It exists only in the form of its salts (carbonates), acid salts (hydrogen carbonates), amines (carbamic acid), and acid chlorides (carbonyl chloride). (From Grant & Hackh's Chemical Dictionary, 5th ed) [ChemIDplus]

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (100%)；STOT SE 3 (100%)

규제 정보

안전 데이터

신호 어: Warning
유해·위험 문구: 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302

화학 및 산업

약리 정보

Cellular LocationsCytoplasm；Extracellular；Mitochondria

Metabolite Pathways · 1건

2-Hydroxyglutric Aciduria (D And L Form)；2-ketoglutarate dehydrogenase complex deficiency；2-Methyl-3-Hydroxybutryl CoA Dehydrogenase Deficiency；3-Hydroxy-3-Methylglutaryl-CoA Lyase Deficiency；3-hydroxyisobutyric acid dehydrogenase deficiency；3-hydroxyisobutyric aciduria；3-Methylcrotonyl Coa Carboxylase Deficiency Type I；3-Methylglutaconic Aciduria Type I；3-Methylglutaconic Aciduria Type III；3-Methylglutaconic Aciduria Type IV；Total 110 pathways, visit the HMDB page for details