기본 정보
- CAS
32422-02-9- 표준 SMILES
O=P(O)(O)CN1CCOP(=O)(O)C1- InChIKey
BFEMYVYZNSBRML-UHFFFAOYSA-N- 분자식
- C4H11NO6P2
- 평균 분자량
- 231.08 g/mol
- 단동위원소 질량
- 231.00616107
이름 및 식별자
- 우선 이름
- Phosphonic acid, P-[(tetrahydro-2-hydroxy-2-oxido-4H-1,4,2-oxazaphosphorin-4-yl)methyl]-
- IUPAC
- (2-hydroxy-2-oxo-1,4,2λ5-oxazaphosphinan-4-yl)methylphosphonic acid
- 영어명
- Tetrahydro-2-hydroxy-4-(phosphonomethyl)-2H-1,4,2-oxazaphosphorine 2-oxide
- 분자식
- C4H11NO6P2
- 분자량
- 231.08
이름 및 동의어
Phosphonic acid, ((tetrahydro-2-hydroxy-2-oxido-4H-1,4,2-oxazaphosphorin-4-yl)methyl)-DTXSID80865634Phosphonic acid, P-((tetrahydro-2-hydroxy-2-oxido-4H-1,4,2-oxazaphosphorin-4-yl)methyl)-Phosphonic acid, [(tetrahydro-2-hydroxy-2-oxido-4H-1,4,2-oxazaphosphorin-4-yl)methyl]-Phosphonic acid, P-[(tetrahydro-2-hydroxy-2-oxido-4H-1,4,2-oxazaphosphorin-4-yl)methyl]-RefChem:862218DTXCID6081402432422-02-9SCHEMBL9352688BFEMYVYZNSBRML-UHFFFAOYSA-NTetrahydro-2-hydroxy-4-(phosphonomethyl)-2H-1,4,2-oxazaphosphorine 2-oxideDB-225161
이름 더 보기
2-Hydroxy-4-(phosphonomethyl)tetrahydro-4H-1,4,2-oxazaphosphorine 2-oxidePhosphonic acid, P-[(tetrahydro-2-hydroxy-2-oxido-4H-1 ,4,2-oxazaphosphorin-4-yl)methyl]-
4-(phosphonomethyl)-2-hydroxy-2-oxo-1,4,2-oxazaphosphorinane[(2-Hydroxy-2-oxido-1,4,2-oxazaphosphinan-4-yl)methyl]phosphonic acid[(2-Hydroxy-2-oxo-1,4,2lambda~5~-oxazaphosphinan-4-yl)methyl]phosphonic acid
데이터베이스 식별자
- CAS
32422-02-9- PubChem CID
- 15936130
- DTXSID
DTXSID80865634- Nikkaji
- J3.087.861B、J422.277F
물성
구조 계산 물성
- XLogP
- -5.2
- 극성 표면적
- 107 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 13
- 형식 전하
- 0
- 복잡도
- 274
실험 및 물리화학적 성질
Physical DescriptionLiquid
물리화학적 성질
- 끓는 점
- 485.7 · 485.7±55.0 °C(Predicted)
- 밀도
- 1.72 · 1.72±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 8.84 · 8.84±0.20(Predicted)
- EPA
- Phosphonic acid, [(tetrahydro-2-hydroxy-2-oxido-4H-1,4,2-oxazaphosphorin-4-yl)methyl]- (32422-02-9)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory Information
Phosphonic acid, P-[(tetrahydro-2-hydroxy-2-oxido-4H-1,4,2-oxazaphosphorin-4-yl)methyl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phosphonic acid, P-[(tetrahydro-2-hydroxy-2-oxido-4H-1,4,2-oxazaphosphorin-4-yl)methyl]- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
U.S. Production2023: 315,877 lb
Industry UsesChelating agent
General Manufacturing Information
All Other Chemical Product and Preparation Manufacturing
Phosphonic acid, P-[(tetrahydro-2-hydroxy-2-oxido-4H-1,4,2-oxazaphosphorin-4-yl)methyl]-: ACTIVE
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